data_2ls8_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 2ls8 _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 ' 3' ' ' CYS . . . . . 0.421 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 78.4 m . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.499 0.19 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.459 ' O ' ' HD1' ' A' ' 7' ' ' TRP . 59.6 Cg_endo -73.23 128.44 12.94 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.696 2.264 . . . . 0.0 114.752 -172.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mt 65.15 -98.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.735 167.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -114.56 9.79 16.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 111.849 -164.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.532 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.5 m95 -68.29 119.7 13.25 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 52.7 mmt-85 -72.68 112.11 8.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.689 0.281 . . . . 0.0 110.77 -175.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.83 121.64 24.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.72 121.69 15.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 60.02 -99.57 0.09 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.398 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 -11.92 9.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.93 0.395 . . . . 0.0 110.492 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -97.46 174.14 6.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.911 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 7' ' ' TRP . 79.5 m -137.79 131.34 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.505 175.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -120.62 123.86 43.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.872 -174.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 75.5 t80 -118.53 116.95 34.76 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.177 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.5 Cg_endo -84.93 135.33 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.156 2.571 . . . . 0.0 112.358 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.462 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.7 mp -122.73 139.35 54.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 p -108.03 22.83 15.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.13 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -87.47 170.32 11.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.123 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -96.04 115.92 28.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.398 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.537 ' HA ' ' HZ2' ' A' ' 22' ' ' LYS . 3.5 mmpm? -148.31 146.58 28.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.8 p -73.99 167.44 21.51 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.62 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 57.9 t90 -65.96 -35.14 79.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.54 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.97 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 31.8 mt-10 -76.86 -32.03 57.22 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.508 ' HB2' HD23 ' A' ' 38' ' ' LEU . 7.1 p -68.55 -39.6 81.03 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.576 177.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.9 -33.67 76.37 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.926 173.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.448 ' HB3' ' HA ' ' A' ' 26' ' ' GLU . 8.2 ttt180 -73.03 -42.05 63.57 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.099 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.48 -32.0 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.246 0.546 . . . . 0.0 109.999 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 32' ' ' SER . 87.9 m -84.82 178.15 7.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 170.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.666 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 40.2 m 75.86 -44.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.729 0.412 . . . . 0.0 111.061 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.96 -23.9 66.27 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.955 173.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -91.05 7.27 41.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.688 0.28 . . . . 0.0 110.608 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.13 90.7 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.44 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -101.44 -176.39 3.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.344 -0.428 . . . . 0.0 111.026 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.719 ' CD2' ' HA ' ' A' ' 77' ' ' ASP . 57.9 m-70 -143.76 170.66 15.45 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 174.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.508 HD23 ' HB2' ' A' ' 27' ' ' SER . 61.1 mt -68.15 163.12 23.32 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.264 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.937 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.4 tpt -53.85 102.33 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.27 0.557 . . . . 0.0 111.799 -177.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.561 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 18.3 p -105.55 104.95 14.77 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.127 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.545 HG12 ' HE3' ' A' ' 39' ' ' MET . 55.5 mt -74.8 95.32 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.892 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.98 -41.26 36.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.868 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 44.9 p -123.65 161.18 25.58 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.907 0.861 . . . . 0.0 111.675 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.93 -16.47 64.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.876 175.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.848 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -79.67 -38.23 34.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.215 174.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -48.38 -49.37 34.89 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.45 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -66.56 -56.36 11.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.857 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.848 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.7 p30 -65.97 -25.14 66.97 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -170.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -87.26 -35.0 18.74 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.615 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -71.45 -31.72 43.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 120.271 -0.572 . . . . 0.0 111.201 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.4 pt -71.48 -4.67 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.935 0.397 . . . . 0.0 111.111 -179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -86.91 -19.46 28.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.645 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.13 -17.48 17.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.235 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.8 mt -82.83 144.19 30.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.287 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.94 133.34 40.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.982 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -76.43 53.26 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.786 -175.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -162.47 -31.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.201 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.612 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -87.17 158.97 19.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.22 0.534 . . . . 0.0 111.267 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.8 m -110.51 121.02 44.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.223 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.662 ' HB3' HG13 ' A' ' 125' ' ' ILE . 84.0 m-85 -107.4 123.74 48.81 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.794 ' HA ' HG13 ' A' ' 103' ' ' VAL . 49.2 m-85 -57.89 137.99 56.17 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.737 HD22 ' HG ' ' A' ' 104' ' ' LEU . 85.1 mt -105.14 163.66 12.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.249 173.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.44 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.62 14.75 34.31 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.623 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.529 ' HG ' ' CE2' ' A' ' 75' ' ' TRP . 1.1 mt -82.66 116.81 22.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.301 0.55 . . . . 0.0 110.195 178.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.62 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 11.1 ttm180 -113.26 126.26 55.21 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.434 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 12.6 t70 -123.89 145.82 48.85 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 156.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.529 ' HG3' ' HD2' ' A' ' 70' ' ' LYS . 4.8 pt-20 -120.63 6.24 10.54 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -162.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.416 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 179.87 29.92 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.917 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 59.7 38.26 21.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.538 0.685 . . . . 0.0 109.456 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.529 ' HD2' ' HG3' ' A' ' 67' ' ' GLU . 96.8 mttt -81.92 -22.85 36.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.074 -173.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 19.66 56.69 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -175.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -100.39 63.59 1.12 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.198 -0.501 . . . . 0.0 110.253 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.414 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.8 m95 -70.06 104.35 2.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.679 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.8 mtm180 -134.11 141.1 47.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.407 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.561 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 79.9 m95 -88.55 125.27 34.7 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 6.2 p -70.63 82.62 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-O 122.141 0.972 . . . . 0.0 110.326 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.719 ' HA ' ' CD2' ' A' ' 37' ' ' HIS . 2.1 t70 -172.88 -59.54 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.591 -174.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 163.34 -31.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.888 1.368 . . . . 0.0 107.615 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.471 ' O ' ' HB2' ' A' ' 75' ' ' TRP . 26.3 m -59.98 120.18 48.14 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.925 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -75.49 169.18 22.92 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 123.023 2.482 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.414 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 61.3 t80 -64.84 125.38 24.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.707 0.289 . . . . 0.0 110.444 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.549 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 4.3 m-80 -80.06 110.49 16.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.4 -31.33 17.88 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.694 2.263 . . . . 0.0 112.307 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.7 -11.91 40.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.524 -178.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.549 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 76.3 mtt180 -127.91 80.39 1.96 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.994 0.426 . . . . 0.0 111.283 -175.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -121.64 98.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -98.94 69.0 1.75 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -65.8 150.03 49.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.953 0.406 . . . . 0.0 111.007 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.489 ' CD2' ' HB2' ' A' ' 112' ' ' ALA . 8.7 t-80 . . . . . 0 C--N 1.326 -0.448 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.434 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 5.1 p30 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 121.587 0.708 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 73.1 m -130.04 127.26 39.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.465 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.565 HG11 ' HB3' ' A' ' 115' ' ' ASP . 30.4 m -81.63 145.67 8.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 0.0 111.59 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.794 HG13 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -128.2 155.46 39.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.009 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.737 ' HG ' HD22 ' A' ' 62' ' ' LEU . 25.9 mt -86.43 105.83 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 171.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.99 141.32 35.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 53.7 t80 -93.09 96.62 10.17 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.021 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.476 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 45.5 t-20 -138.83 140.46 38.51 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.38 27.24 16.89 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 5.5 m-20 62.14 17.06 8.84 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.127 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -121.6 133.37 54.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.383 0.611 . . . . 0.0 111.302 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -79.77 124.98 29.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.071 171.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.489 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . . . -163.56 170.12 17.7 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.595 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -73.65 125.81 28.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.242 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -124.59 120.25 31.37 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.565 ' HB3' HG11 ' A' ' 102' ' ' VAL . 10.5 p-10 -89.79 124.85 35.01 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.465 0.65 . . . . 0.0 110.378 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.38 159.4 69.45 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.965 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -49.57 128.55 21.16 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.52 2.147 . . . . 0.0 110.781 172.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 10.6 m -74.07 -4.09 33.42 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.901 0.382 . . . . 0.0 111.446 -173.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -90.44 0.5 57.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.552 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -82.99 140.97 32.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.87 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -93.05 132.2 37.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.105 0.479 . . . . 0.0 111.153 177.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -152.9 -171.4 3.92 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.343 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 36.2 m -81.2 170.31 16.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.462 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 14.2 ptt180 -149.08 159.85 43.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.201 0.524 . . . . 0.0 112.32 -171.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.937 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 39.9 mt -123.55 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.1 t -112.33 130.4 55.96 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -115.63 123.89 49.55 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.655 -176.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.45 HG22 ' HB2' ' A' ' 14' ' ' CYS . 13.8 tt -114.06 135.83 22.14 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 176.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.72 167.02 22.26 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.413 2.075 . . . . 0.0 111.015 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.9 54.1 2.15 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.058 177.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.7 t -88.06 2.22 52.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.055 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.3 m -61.9 -26.86 68.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.034 0.445 . . . . 0.0 110.487 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.92 -30.07 69.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.301 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -87.5 -14.51 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.203 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.556 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -90.76 22.03 3.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.936 -175.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.553 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -64.41 -63.65 1.08 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.166 -0.214 . . . . 0.0 111.426 -176.469 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.553 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 37.7 m-80 -85.18 -23.7 28.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.982 0.42 . . . . 0.0 110.138 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.556 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 2.3 tm? -58.96 -54.88 42.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.928 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.675 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 56.5 t80 -75.58 -20.35 58.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.058 0.456 . . . . 0.0 110.343 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -66.32 -28.33 68.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 0.0 109.851 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -86.95 -31.15 20.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.65 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' SER . . . . . 0.675 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 99.0 p . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.462 -171.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 p . . . . . 0 N--CA 1.451 -0.411 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.423 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 12.6 Cg_exo -70.91 170.5 17.81 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.841 2.36 . . . . 0.0 111.401 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.514 HD11 ' H ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -61.68 -10.34 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.917 0.389 . . . . 0.0 111.193 176.296 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.37 -35.63 81.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.191 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.423 ' CD1' ' HD2' ' A' ' 4' ' ' PRO . 16.2 m95 -84.85 142.78 29.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.301 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -85.19 107.34 17.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.801 0.334 . . . . 0.0 110.171 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.39 135.48 39.48 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.86 178.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.441 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 78.5 t80 -133.8 110.09 9.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.547 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 67.64 -68.42 0.16 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.041 0.838 . . . . 0.0 110.932 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 p -145.88 -28.24 0.43 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.94 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -86.37 170.95 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.912 0.386 . . . . 0.0 111.15 -174.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.544 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 8.3 m -123.23 132.7 54.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.773 -176.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.457 ' CE1' ' HB2' ' A' ' 127' ' ' LYS . 90.2 m-85 -129.03 129.89 45.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.732 0.301 . . . . 0.0 111.519 -174.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.406 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 59.6 t80 -129.5 117.79 18.79 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.891 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -88.58 136.33 3.21 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.293 2.662 . . . . 0.0 112.262 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.58 137.81 52.35 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.8 p -91.05 -4.17 56.58 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.104 0.478 . . . . 0.0 111.061 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' HA ' ' A' ' 123' ' ' SER . 16.3 t70 -77.22 154.01 33.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.935 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 43.3 m-80 -108.5 140.2 42.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.712 0.291 . . . . 0.0 111.566 -170.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.831 ' HB2' ' HD3' ' A' ' 124' ' ' ARG . 48.8 mmtt -168.22 148.48 4.81 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.231 -177.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.523 HG22 ' OE2' ' A' ' 121' ' ' GLU . 73.2 p -64.47 173.34 2.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.481 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -60.24 -45.9 91.64 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -61.68 -48.9 78.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.722 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.723 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 4.7 mm-40 -60.59 -40.86 93.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.478 179.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.595 ' HA ' ' HD2' ' A' ' 124' ' ' ARG . 70.9 m -56.84 -45.58 82.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.307 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -76.91 -21.43 54.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.989 -176.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 34.7 mtm180 -73.08 -43.32 61.98 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.28 0.562 . . . . 0.0 110.149 173.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.49 -35.6 79.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.809 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 32' ' ' SER . 0.1 OUTLIER -85.56 -179.24 6.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.329 174.139 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 57.8 m 75.25 -43.91 0.52 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.784 0.434 . . . . 0.0 112.06 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.95 -21.06 60.79 Favored Glycine 0 C--O 1.227 -0.3 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.032 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.7 ptp -100.16 8.25 43.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.017 0.437 . . . . 0.0 110.636 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.82 29.97 53.32 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.343 -178.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.86 -178.8 4.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.545 0.212 . . . . 0.0 110.918 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.526 ' HB3' HG13 ' A' ' 76' ' ' VAL . 4.7 m-70 -143.12 168.2 20.31 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -57.42 157.45 6.66 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 111.62 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.63 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.6 tpt -52.92 99.4 0.02 OUTLIER 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.505 -176.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.456 ' H ' ' HG2' ' A' ' 127' ' ' LYS . 7.4 p -97.15 90.44 5.14 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.314 170.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.439 HG12 ' HE3' ' A' ' 39' ' ' MET . 42.5 mt -55.65 106.08 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.862 -178.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m -70.78 -51.47 26.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.596 -177.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.6 p -130.12 161.38 31.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.38 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.499 ' CD ' HH21 ' A' ' 84' ' ' ARG . 6.1 pt-20 -66.69 -27.94 68.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.986 0.422 . . . . 0.0 110.293 176.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.02 -36.78 84.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.164 174.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.56 -45.71 91.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.168 176.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.438 ' O ' HG21 ' A' ' 51' ' ' ILE . 55.1 tt0 -56.95 -53.88 52.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.05 175.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -58.87 -24.14 61.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.161 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -81.99 -52.08 7.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.531 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -66.92 -30.54 49.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.768 0.318 . . . . 0.0 111.619 -172.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.695 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.3 pt -73.16 -1.41 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.996 0.426 . . . . 0.0 111.746 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -83.58 -26.25 30.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.942 175.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -99.13 -23.78 15.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.484 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 83.6 mt -63.95 135.6 56.64 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.503 ' HB3' HD22 ' A' ' 58' ' ' LEU . 12.0 t70 -71.47 124.51 24.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.605 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 81.8 mtt180 -79.05 20.21 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -168.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.862 ' HG2' HD21 ' A' ' 58' ' ' LEU . 2.7 ptp180 -116.18 -15.71 11.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.721 0.296 . . . . 0.0 110.356 174.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.862 HD21 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -97.41 172.64 7.63 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.387 0.613 . . . . 0.0 111.439 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -128.28 117.95 22.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.061 176.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.497 ' HB3' HG13 ' A' ' 125' ' ' ILE . 78.2 m-85 -101.59 127.54 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.315 -171.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.648 ' HA ' HG12 ' A' ' 103' ' ' VAL . 1.7 m-85 -62.04 145.01 54.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.154 0.502 . . . . 0.0 112.232 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.655 ' HB2' HG12 ' A' ' 102' ' ' VAL . 95.9 mt -112.61 168.61 9.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.679 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -74.44 3.8 38.56 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 115.18 0.832 . . . . 0.0 115.18 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.902 ' HB2' HG11 ' A' ' 102' ' ' VAL . 4.0 mm? -73.46 117.34 15.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 118.244 1.022 . . . . 0.0 110.903 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -120.23 122.64 41.36 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.331 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.535 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 29.9 t70 -141.78 90.69 2.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.852 0.834 . . . . 0.0 109.911 163.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.593 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -74.45 -71.04 0.36 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.621 -177.767 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -84.67 31.61 0.53 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.459 -170.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 49.73 69.93 0.55 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.219 0.533 . . . . 0.0 111.559 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -95.53 -12.79 25.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.12 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.45 -40.35 2.58 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.014 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -81.16 98.04 7.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.073 0.463 . . . . 0.0 110.751 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.569 ' HB3' HD11 ' A' ' 64' ' ' LEU . 58.6 m95 -59.82 128.04 34.93 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.993 175.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -121.09 129.75 53.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.23 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.702 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 55.6 m95 -81.61 108.14 14.94 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.388 178.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.526 HG13 ' HB3' ' A' ' 37' ' ' HIS . 48.0 t 45.77 -80.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.706 1.254 . . . . 0.0 114.117 172.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 75' ' ' TRP . 4.3 t70 -96.33 -82.5 0.39 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.919 -168.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.44 -19.21 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.702 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 70.1 m -62.69 118.71 44.11 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 120.936 0.398 . . . . 0.0 111.928 -170.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.5 Cg_exo -71.09 169.8 19.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.616 2.877 . . . . 0.0 112.555 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.2 151.24 47.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.345 0.593 . . . . 0.0 110.976 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.632 ' ND2' ' HB2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -119.4 127.08 26.65 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.125 -174.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.79 -30.3 34.04 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.859 2.373 . . . . 0.0 112.48 175.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.499 HH21 ' CD ' ' A' ' 44' ' ' GLU . 11.2 tpt180 -78.12 -49.81 13.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.564 0.221 . . . . 0.0 111.484 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.632 ' HB2' ' ND2' ' A' ' 82' ' ' ASN . 29.9 mtm180 -80.49 81.25 6.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.069 0.461 . . . . 0.0 110.431 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.502 HG13 ' CD1' ' A' ' 88' ' ' TRP . 95.9 t -138.26 103.75 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.558 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.448 ' HB2' ' CD1' ' A' ' 113' ' ' TRP . 50.7 m-85 -125.93 39.66 3.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.502 ' CD1' HG13 ' A' ' 86' ' ' VAL . 66.2 m95 -65.77 160.46 22.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.611 0.243 . . . . 0.0 111.461 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.676 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 77.3 m-70 . . . . . 0 CA--C 1.517 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.126 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.535 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 6.9 p30 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 121.346 0.593 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 63.9 m -135.93 144.34 45.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.867 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.902 HG11 ' HB2' ' A' ' 64' ' ' LEU . 12.1 p -100.43 146.74 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 120.987 0.422 . . . . 0.0 111.432 -175.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 61' ' ' PHE . 22.6 m -129.85 156.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.763 175.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.569 ' HG ' HD22 ' A' ' 62' ' ' LEU . 31.8 mt -88.52 113.4 24.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 171.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -125.8 141.33 45.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.397 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.515 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 61.3 t80 -79.92 103.84 10.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.151 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.676 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 26.1 t-20 -149.19 135.47 19.21 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.445 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 91.4 mt-30 66.38 31.9 7.97 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -172.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.405 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 12.5 m-20 59.53 26.25 15.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.732 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -145.56 153.1 40.72 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.196 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.695 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 88.0 m95 -87.53 107.05 18.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.853 176.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.62 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . . . -129.32 167.31 17.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.944 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.513 ' HB3' HG21 ' A' ' 102' ' ' VAL . 25.2 m0 -74.74 129.16 37.21 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.268 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -127.18 139.63 52.81 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.19 125.24 34.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.737 0.303 . . . . 0.0 111.178 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -143.41 158.05 58.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.513 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -58.28 138.11 84.12 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.517 2.145 . . . . 0.0 111.771 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.6 m -70.49 -18.76 62.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.714 0.292 . . . . 0.0 111.029 -178.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -86.1 16.07 4.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.294 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -100.07 126.63 46.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.523 ' OE2' HG22 ' A' ' 23' ' ' THR . 3.2 mm-40 -73.49 124.18 25.33 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -144.16 176.64 9.17 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.475 177.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.499 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 35.0 m -67.55 157.62 33.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.894 0.378 . . . . 0.0 110.7 -177.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.831 ' HD3' ' HB2' ' A' ' 22' ' ' LYS . 80.6 mtm-85 -124.18 153.15 41.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.999 0.428 . . . . 0.0 111.984 -169.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.63 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 58.9 mt -134.92 120.72 31.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 171.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 12.5 m -103.49 131.75 50.34 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.457 ' HB2' ' CE1' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -123.33 135.55 54.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.221 0.534 . . . . 0.0 110.006 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.544 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -128.62 140.17 37.68 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.562 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.77 166.88 3.37 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.617 2.212 . . . . 0.0 111.981 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -71.57 59.19 1.24 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.008 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 77.4 p -71.6 -22.44 61.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.069 0.461 . . . . 0.0 110.349 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.8 m -71.93 -14.57 61.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.061 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 mp -80.06 -32.35 39.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -31.24 20.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.27 41.6 1.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.52 175.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -44.6 79.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.028 -173.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -72.61 -27.21 62.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.316 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.05 -48.3 74.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -71.53 -23.26 61.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.282 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -67.97 -33.09 73.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 0.0 110.243 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -87.93 -6.47 58.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.435 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.103 -175.829 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.0 m . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -52.82 142.07 52.99 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.063 1.842 . . . . 0.0 111.131 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.3 mt -73.79 80.47 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -173.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 176.68 -51.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.214 -1.357 . . . . 0.0 108.206 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -42.23 123.74 2.57 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.295 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -71.74 107.21 4.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 128.31 33.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.235 -176.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.463 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 83.8 t80 -139.25 102.11 4.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.644 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 60.67 -89.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.139 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 m -120.27 7.56 10.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.682 0.277 . . . . 0.0 111.282 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -130.35 158.51 39.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.856 0.36 . . . . 0.0 110.99 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.545 ' HB2' HG21 ' A' ' 128' ' ' ILE . 74.9 m -131.97 127.52 36.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.628 ' HH ' ' HG2' ' A' ' 46' ' ' GLU . 79.2 m-85 -115.41 129.06 56.45 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -170.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -121.34 114.87 31.6 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -88.48 123.36 1.54 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.326 2.684 . . . . 0.0 112.288 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.451 HD23 ' CZ ' ' A' ' 124' ' ' ARG . 4.7 mp -109.82 139.39 44.95 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 p -105.31 14.98 28.07 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.373 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -85.83 162.29 18.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.0 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.457 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 20.0 m120 -85.12 118.24 24.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 1.003 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -149.03 141.73 24.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.772 178.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.54 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 62.8 p -72.63 174.55 7.39 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 174.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.436 ' CH2' HG21 ' A' ' 76' ' ' VAL . 31.2 t90 -62.42 -39.75 94.29 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.3 68.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.764 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 1.003 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 15.8 mm-40 -61.14 -37.32 82.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.456 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.403 ' HB2' HD21 ' A' ' 38' ' ' LEU . 68.8 m -60.05 -49.29 78.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.715 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.645 ' HG2' HD12 ' A' ' 38' ' ' LEU . 19.6 mm-40 -69.69 -22.02 63.45 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.407 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -67.93 -39.81 83.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.79 0.329 . . . . 0.0 110.918 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.28 -25.98 36.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.333 0.587 . . . . 0.0 109.567 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.421 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 88.4 m -85.65 -180.0 6.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.522 172.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 51.7 m 73.34 -44.92 0.6 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.928 0.491 . . . . 0.0 111.66 -178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.63 -22.99 66.59 Favored Glycine 0 C--O 1.227 -0.336 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.758 174.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.5 mtm -96.93 9.53 41.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.33 . . . . 0.0 110.696 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.64 27.75 68.68 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.998 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.85 173.83 10.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.475 0.178 . . . . 0.0 111.028 -175.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -140.2 168.66 19.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.645 HD12 ' HG2' ' A' ' 28' ' ' GLU . 10.8 mp -61.44 149.42 38.63 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.209 0.318 . . . . 0.0 110.37 173.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.55 ' HE2' HG12 ' A' ' 41' ' ' ILE . 12.4 tpt -50.71 103.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -175.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.439 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 11.8 p -94.45 94.85 8.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.077 172.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.55 HG12 ' HE2' ' A' ' 39' ' ' MET . 55.9 mt -66.99 95.8 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.237 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.9 m -92.75 -27.79 17.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.299 0.571 . . . . 0.0 109.811 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 53.0 p -125.2 147.87 48.87 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 122.238 1.018 . . . . 0.0 112.163 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.419 ' OE2' ' HD3' ' A' ' 85' ' ' ARG . 19.9 mt-10 -59.9 -31.45 69.83 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.629 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.446 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.4 -46.04 88.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.582 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.628 ' HG2' ' HH ' ' A' ' 15' ' ' TYR . 24.7 mt-10 -49.23 -55.29 13.05 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.583 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.36 -52.69 62.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.001 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -59.25 -34.77 72.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.446 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 59.9 m-85 -88.31 -37.7 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.601 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.6 tp -70.21 -30.75 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.283 -174.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.479 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 37.4 pt -71.29 -6.08 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.309 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -87.44 -21.54 25.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.025 176.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -94.81 -23.91 17.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.636 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.6 mt -74.28 139.84 44.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.543 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.408 ' HB3' HD22 ' A' ' 58' ' ' LEU . 12.0 t70 -75.36 133.81 41.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.552 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 81.5 mtt180 -80.22 16.71 1.19 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -169.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.92 ' HG2' HD21 ' A' ' 58' ' ' LEU . 2.9 ptp180 -119.59 -12.31 9.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.719 176.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.92 HD21 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -103.11 148.3 25.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.174 0.511 . . . . 0.0 111.607 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 p -100.5 116.91 33.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.541 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.632 ' HB3' HG13 ' A' ' 125' ' ' ILE . 95.4 m-85 -100.77 121.69 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.48 -174.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.835 ' HA ' HG13 ' A' ' 103' ' ' VAL . 14.1 m-85 -58.41 137.42 57.29 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.765 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.589 HD23 ' HG ' ' A' ' 104' ' ' LEU . 96.4 mt -105.61 157.11 17.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.942 176.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.463 ' O ' ' HE3' ' A' ' 75' ' ' TRP . . . -79.06 61.83 4.07 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.442 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.603 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 21.3 tp -129.64 134.22 47.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -135.33 134.91 40.33 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -170.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -133.61 88.96 2.53 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 164.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -81.84 134.05 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.89 0.376 . . . . 0.0 111.519 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 70.07 18.41 7.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.47 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.23 87.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.314 0.578 . . . . 0.0 111.662 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.466 ' HE3' ' HB2' ' A' ' 70' ' ' LYS . 21.2 mtmt -112.38 -47.72 3.07 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.414 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.8 -19.3 47.59 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -94.9 83.85 4.06 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 121.227 0.537 . . . . 0.0 110.033 176.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.603 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 60.5 m95 -66.23 137.28 56.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.501 -178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.428 ' O ' HD13 ' A' ' 64' ' ' LEU . 63.7 mtt180 -125.65 166.11 17.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.53 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 96.7 m95 -81.56 176.56 9.56 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.719 -0.793 . . . . 0.0 109.307 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.436 HG21 ' CH2' ' A' ' 24' ' ' TRP . 13.7 p -63.07 -34.4 66.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.854 0.359 . . . . 0.0 111.38 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -107.24 -168.78 1.44 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 177.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -77.6 73.72 4.17 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.42 0.629 . . . . 0.0 110.161 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 8.1 m -131.15 129.22 22.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.222 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 19.3 Cg_exo -68.66 144.91 61.83 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.237 2.625 . . . . 0.0 112.271 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -69.43 143.43 53.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.17 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 25.3 m-80 -77.55 110.39 12.55 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.704 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.94 -50.37 0.84 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.984 2.456 . . . . 0.0 112.776 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -82.71 -0.88 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 111.507 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.538 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 29.8 mtm180 -129.55 62.85 1.53 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 p -85.31 -32.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.261 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 66.7 -70.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 174.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 76.8 m95 53.49 -158.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.746 -167.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.581 ' CD2' ' HB1' ' A' ' 112' ' ' ALA . 10.4 t-80 . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.886 0.374 . . . . 0.0 110.952 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 N--CA 1.45 -0.475 0 CA-C-O 121.414 0.626 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 2.2 p -157.66 136.57 11.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.964 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 30.1 m -88.67 147.7 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.408 0.623 . . . . 0.0 112.155 -173.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.835 HG13 ' HA ' ' A' ' 61' ' ' PHE . 25.2 m -124.5 158.62 31.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.14 174.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.589 ' HG ' HD23 ' A' ' 62' ' ' LEU . 31.7 mt -84.0 115.64 22.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.5 p -125.87 141.49 45.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.688 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.552 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 63.4 t80 -91.19 97.5 11.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.4 176.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.406 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 47.7 t-20 -141.38 132.93 26.97 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 66.18 31.85 8.42 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 123.838 0.712 . . . . 0.0 109.32 -171.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.464 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 15.2 m-20 60.09 25.06 14.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 114.55 -1.205 . . . . 0.0 112.414 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -132.97 141.58 48.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 0.0 111.018 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.479 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 83.2 m95 -88.37 110.77 21.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.762 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.581 ' HB1' ' CD2' ' A' ' 89' ' ' HIS . . . -148.47 170.84 17.14 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.089 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -73.91 134.29 43.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.757 -175.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -134.01 123.93 25.4 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.08 131.68 38.5 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 19.4 m -140.75 158.89 64.46 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.337 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -59.22 128.69 28.45 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.302 2.001 . . . . 0.0 111.138 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.54 ' O ' ' HB ' ' A' ' 23' ' ' THR . 83.6 m -65.84 -17.34 64.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -177.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -82.49 -2.29 52.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.771 0.319 . . . . 0.0 111.263 177.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -83.7 115.45 22.19 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.522 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 1.4 mt-10 -72.34 110.64 6.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.452 0.644 . . . . 0.0 110.671 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -130.44 -172.05 2.7 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.511 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 33.1 m -78.25 169.57 18.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.451 ' CZ ' HD23 ' A' ' 18' ' ' LEU . 11.9 ptt180 -151.04 150.24 30.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.098 0.475 . . . . 0.0 111.91 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.632 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.1 mt -115.24 121.37 67.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.94 121.46 44.82 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 40' ' ' THR . 22.3 ptmt -115.41 127.36 55.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.985 0.422 . . . . 0.0 111.048 -176.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.545 HG21 ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -103.98 134.18 19.85 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.24 167.47 25.79 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.076 1.85 . . . . 0.0 110.938 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -68.26 60.86 0.41 Allowed Glycine 0 CA--C 1.521 0.442 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.131 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -76.63 10.37 2.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.198 0.523 . . . . 0.0 111.304 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.9 m -67.28 -18.58 65.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.583 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.03 -34.48 66.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.182 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -77.42 -38.3 49.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 0.0 109.337 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -85.46 31.22 0.59 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.981 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 12.3 pt-20 -60.12 -35.21 74.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.715 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.402 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 76.8 m-20 -73.31 -28.64 62.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.548 -177.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -68.17 -20.34 64.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.46 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -71.71 -38.58 70.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -73.91 -40.27 63.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.241 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 44.4 m . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.57 -179.269 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.607 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 71.3 m . . . . . 0 C--O 1.234 0.246 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 95.1 Cg_exo -46.98 147.68 4.74 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 121.818 1.679 . . . . 0.0 111.851 170.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tp -59.38 146.86 8.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.945 -172.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 77.81 -33.79 0.18 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.51 1.124 . . . . 0.0 112.023 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.509 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 24.1 m95 -47.73 118.6 2.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.817 0.341 . . . . 0.0 110.124 175.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.3 mmt-85 -71.47 113.45 8.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.481 -172.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.52 124.13 31.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.774 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.428 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 33.0 t80 -121.44 104.33 9.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 58.89 -101.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.435 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 t -96.91 -36.16 10.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.346 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -80.42 169.12 18.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.562 -173.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.96 136.33 26.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.366 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.428 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 24.9 m-85 -121.71 131.86 54.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.251 -169.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -111.67 115.26 51.55 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.198 176.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -89.09 124.85 1.5 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 123.107 2.538 . . . . 0.0 111.574 174.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.496 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -138.01 143.9 40.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.402 0.62 . . . . 0.0 111.272 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 73.9 p -110.27 18.77 19.56 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.798 -170.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -78.58 130.51 36.02 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.423 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.61 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 4.8 m-20 -63.48 100.52 0.26 Allowed 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.921 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.61 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 14.8 mmmm -133.63 143.75 48.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.614 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.4 p -65.79 163.85 15.9 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 174.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 60.0 t90 -57.76 -39.35 77.2 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.12 -51.67 68.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.892 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.542 ' HA ' ' HB2' ' A' ' 29' ' ' ARG . 14.5 mm-40 -70.57 -26.92 63.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.239 -177.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 53.1 m -58.0 -50.39 73.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.763 0.316 . . . . 0.0 110.33 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -70.81 -25.89 63.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.658 178.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -71.1 -51.43 25.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.938 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.41 ' HB3' HH12 ' A' ' 124' ' ' ARG . 3.7 t-20 -74.94 -30.67 61.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.1 0.476 . . . . 0.0 110.579 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.5 m -84.51 179.42 7.41 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 171.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 17.2 m 80.04 -45.11 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.532 0.733 . . . . 0.0 109.966 -174.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.67 -25.7 70.53 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.669 171.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.554 ' HG3' ' H ' ' A' ' 36' ' ' ALA . 21.7 ptp -88.7 1.79 54.49 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 110.573 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.44 -13.11 59.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.217 -176.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.554 ' H ' ' HG3' ' A' ' 34' ' ' MET . . . -95.43 141.13 29.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.89 -0.182 . . . . 0.0 110.512 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.552 ' CD2' HG11 ' A' ' 76' ' ' VAL . 13.5 t60 -118.97 158.14 26.34 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB2' HG21 ' A' ' 76' ' ' VAL . 5.9 mp -51.71 139.03 22.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -174.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.661 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.0 tpt -40.02 98.68 0.01 OUTLIER 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.436 -1.256 . . . . 0.0 113.448 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.491 HG22 ' OD2' ' A' ' 77' ' ' ASP . 6.4 p -94.79 91.84 6.67 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.453 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.623 HG12 ' HE3' ' A' ' 39' ' ' MET . 59.9 mt -59.4 100.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -85.64 -34.4 21.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.032 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.557 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 35.1 p -130.23 151.61 50.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.379 0.609 . . . . 0.0 111.374 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -65.86 -35.51 80.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.851 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.432 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.3 -41.51 98.57 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 120.914 0.387 . . . . 0.0 110.357 175.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.557 ' HB3' ' O ' ' A' ' 43' ' ' THR . 66.4 tt0 -52.34 -51.76 57.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.611 175.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.83 -46.05 90.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.66 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -62.39 -28.36 69.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.116 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.533 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 15.9 m-85 -85.32 -31.87 22.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.56 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.8 tp -78.36 -32.69 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.029 -0.668 . . . . 0.0 111.384 -176.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.2 pt -65.28 -20.47 27.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.5 pt20 -87.79 -11.36 48.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.097 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -92.48 -26.34 18.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.049 0.452 . . . . 0.0 110.03 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 68.0 mt -77.05 159.94 29.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.982 -176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -70.61 137.75 50.23 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.826 174.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -90.23 38.82 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.168 0.509 . . . . 0.0 111.698 -171.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -142.15 -46.83 0.35 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.53 172.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.67 163.49 7.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.797 0.808 . . . . 0.0 112.737 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.583 ' HB3' ' CG1' ' A' ' 103' ' ' VAL . 1.4 m -108.17 129.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.94 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.506 ' N ' HG22 ' A' ' 103' ' ' VAL . 97.4 m-85 -117.38 120.15 37.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.517 0.198 . . . . 0.0 111.425 -175.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.94 130.15 42.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.084 0.468 . . . . 0.0 111.175 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.709 HD12 ' HB2' ' A' ' 104' ' ' LEU . 80.1 mt -111.63 175.93 5.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.337 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.73 39.44 2.71 Favored Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.69 -175.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.707 ' HB2' HG23 ' A' ' 102' ' ' VAL . 3.5 mm? -100.18 114.32 27.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.412 ' HD3' ' NH2' ' A' ' 74' ' ' ARG . 7.9 ttt85 -120.41 114.8 22.35 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -168.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -127.97 105.68 8.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 166.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -46.81 -78.24 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.902 -1.045 . . . . 0.0 113.265 -175.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -127.8 48.06 2.31 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.269 -170.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.35 70.87 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.595 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -87.57 -15.53 37.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.818 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.83 -45.41 3.47 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -175.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.21 92.13 6.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.692 0.758 . . . . 0.0 110.086 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -69.69 160.83 30.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.375 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.412 ' NH2' ' HD3' ' A' ' 65' ' ' ARG . 16.5 ptt180 -154.1 171.8 18.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.298 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -84.06 -176.18 6.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.976 0.417 . . . . 0.0 110.197 174.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.552 HG11 ' CD2' ' A' ' 37' ' ' HIS . 13.3 p -82.29 1.29 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.215 0.531 . . . . 0.0 111.486 -171.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.491 ' OD2' HG22 ' A' ' 40' ' ' THR . 1.6 p30 -123.89 -104.74 0.36 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.089 176.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -121.16 -23.59 5.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.1 m -54.46 123.02 41.6 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.634 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 27.3 Cg_exo -65.18 149.06 89.26 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.135 2.556 . . . . 0.0 111.988 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.82 136.92 57.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.838 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -87.81 112.15 47.01 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.88 7.4 4.63 Favored 'Trans proline' 0 CA--C 1.53 0.296 0 C-N-CA 122.646 2.231 . . . . 0.0 113.705 -174.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -119.27 -27.12 5.71 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.418 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -106.83 34.46 3.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.401 ' O ' HG11 ' A' ' 86' ' ' VAL . 6.2 p -80.42 95.76 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.846 0.832 . . . . 0.0 109.811 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -81.71 72.82 8.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.381 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -69.78 152.39 44.66 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.563 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 11.6 t-80 . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.901 -171.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 121.573 0.701 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 67.5 m -117.66 156.27 28.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.831 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 23.0 m -103.25 155.79 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.255 0.55 . . . . 0.0 110.819 177.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.688 ' O ' ' HA ' ' A' ' 113' ' ' TRP . 0.4 OUTLIER -123.03 143.98 34.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.533 176.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.709 ' HB2' HD12 ' A' ' 62' ' ' LEU . 17.8 tp -85.49 103.54 14.46 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 171.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.473 HG11 ' OD1' ' A' ' 114' ' ' ASN . 10.0 p -128.33 139.2 52.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.176 0.512 . . . . 0.0 111.785 -172.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.569 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 11.6 t80 -88.37 104.49 16.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -146.71 142.02 27.39 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.573 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 39.6 mt-30 53.46 65.69 1.45 Allowed 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.638 0.586 . . . . 0.0 110.342 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.1 p30 58.76 4.35 0.38 Allowed 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 173.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 108' ' ' GLN . 9.4 pttm -155.56 153.56 30.35 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.569 ' NE1' ' HD2' ' A' ' 106' ' ' TYR . 81.0 m95 -84.07 140.54 31.76 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.019 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.563 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -179.27 -179.4 0.55 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.65 0.594 . . . . 0.0 109.907 173.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 39.4 m0 -88.48 139.33 30.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.728 0.299 . . . . 0.0 111.03 -177.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.633 ' C ' HD21 ' A' ' 114' ' ' ASN . 0.1 OUTLIER -123.41 162.19 23.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.04 171.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.35 124.69 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.254 0.346 . . . . 0.0 110.928 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -147.77 141.89 16.1 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.204 175.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.526 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.0 Cg_endo -55.86 136.02 72.49 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.476 2.117 . . . . 0.0 111.395 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.0 m -67.15 -17.43 64.85 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.883 0.373 . . . . 0.0 110.665 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.32 7.27 33.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.614 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.8 t80 -88.98 143.76 26.63 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.75 135.7 35.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.873 0.368 . . . . 0.0 110.947 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.3 -168.8 1.96 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.543 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.403 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 20.2 m -78.59 169.44 18.24 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.468 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 13.0 ptt180 -147.25 162.91 37.95 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -172.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.661 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 8.3 mm -126.19 123.63 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.249 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 93.0 m -123.21 127.65 48.91 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.996 0.427 . . . . 0.0 110.293 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 40' ' ' THR . 21.6 ptmt -116.29 140.14 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.871 -175.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.443 HD12 ' HG1' ' A' ' 131' ' ' THR . 16.0 tt -125.96 145.29 51.49 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.211 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.06 167.33 14.43 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.514 2.143 . . . . 0.0 111.444 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.32 74.46 0.54 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.757 175.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.443 ' HG1' HD12 ' A' ' 128' ' ' ILE . 25.8 p -83.19 19.51 1.45 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.506 0.323 . . . . 0.0 111.864 -175.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 14.5 t -60.15 -24.94 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.451 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.6 mt -82.1 -23.83 35.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -89.47 -49.51 6.65 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.341 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.52 33.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.67 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.646 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -59.76 -64.21 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -175.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.646 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 6.2 p30 -84.3 -20.29 32.36 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.66 -45.52 89.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.566 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -72.69 -21.56 61.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.38 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -73.31 -23.42 60.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.357 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 73.5 mt-30 -86.07 -6.8 58.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 177.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.01 -177.206 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m . . . . . 0 C--O 1.233 0.211 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -51.9 154.67 9.56 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.567 2.178 . . . . 0.0 112.489 176.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.8 tp -70.2 -14.88 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.817 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.59 -31.74 68.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.987 176.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.409 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 24.1 m95 -86.5 160.67 18.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.704 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.3 mmt-85 -111.8 122.89 49.02 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.112 177.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.37 124.29 42.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.121 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.438 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 82.9 t80 -121.8 103.27 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.837 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 65.6 -73.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.1 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 m -139.32 5.38 2.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -175.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -123.95 157.88 33.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.788 0.327 . . . . 0.0 111.003 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.8 m -122.87 128.0 49.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.681 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.438 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 3.7 m-85 -119.35 138.15 53.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.18 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.409 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 62.1 t80 -139.23 115.68 8.51 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -88.01 138.11 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.839 2.36 . . . . 0.0 112.293 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.45 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.8 mp -124.43 139.6 53.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.974 0.416 . . . . 0.0 110.143 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.5 p -110.31 35.19 3.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.871 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.86 -27.23 40.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.3 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.514 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 46.6 m-80 70.08 116.19 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.62 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.629 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 13.3 mmmm -159.37 150.44 19.83 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.663 HG22 ' OE2' ' A' ' 121' ' ' GLU . 16.6 p -60.38 166.8 2.83 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 170.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.466 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 63.3 t90 -59.32 -42.26 90.98 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.41 -51.34 69.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.74 176.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.629 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 32.4 mm-40 -68.14 -31.22 70.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.4 ' HB3' HD21 ' A' ' 38' ' ' LEU . 54.2 m -65.27 -40.74 94.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.822 0.344 . . . . 0.0 110.236 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -71.31 -34.02 70.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.761 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 98.0 mtt180 -69.68 -40.15 76.54 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.845 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -76.16 -25.82 55.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.39 0.614 . . . . 0.0 109.769 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 32' ' ' SER . 67.0 m -85.68 -179.45 6.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 167.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 29.1 m 79.46 -43.68 0.3 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.064 0.546 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.88 -25.18 67.48 Favored Glycine 0 C--O 1.227 -0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.807 173.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 71.5 mtm -94.61 7.1 46.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.871 0.367 . . . . 0.0 110.392 177.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.6 -6.68 64.26 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.152 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.499 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . . . -95.39 162.83 13.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.522 0.201 . . . . 0.0 110.69 -177.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -133.4 168.57 18.37 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 38' ' ' LEU . 76.1 mt -61.39 146.28 48.8 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.931 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.616 ' HE3' HG12 ' A' ' 41' ' ' ILE . 12.6 tpt -44.88 110.79 0.25 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.161 0.913 . . . . 0.0 113.178 -172.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.483 HG22 ' HB3' ' A' ' 75' ' ' TRP . 23.7 p -101.8 105.76 16.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.892 173.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.616 HG12 ' HE3' ' A' ' 39' ' ' MET . 45.4 mt -79.2 119.42 28.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.091 0.472 . . . . 0.0 110.538 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.5 p -106.58 -36.62 6.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.261 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 70.5 p -127.71 152.97 47.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 112.032 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.93 -33.05 74.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.53 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.43 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -68.29 -44.45 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.622 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -52.54 -48.71 65.94 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.885 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -59.96 -48.94 79.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.978 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -62.19 -23.09 66.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.238 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.43 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 30.5 m-85 -88.33 -39.07 14.64 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 177.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -71.4 -30.49 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.305 -176.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.1 pt -71.62 -3.96 4.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.85 0.357 . . . . 0.0 111.312 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -87.25 -21.74 25.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.852 175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 -19.77 18.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.151 178.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 79.1 mt -79.06 134.05 36.77 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.966 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.25 128.29 35.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.964 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.1 mtt180 -72.39 53.78 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.717 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -160.33 -29.95 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.317 177.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.717 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -86.9 158.39 19.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.29 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.7 m -109.47 118.89 37.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.527 176.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.745 ' HB3' HG13 ' A' ' 125' ' ' ILE . 91.4 m-85 -105.23 120.91 42.71 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.757 0.281 . . . . 0.0 111.757 -173.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.728 ' HA ' HG11 ' A' ' 103' ' ' VAL . 13.8 m-85 -58.6 137.87 57.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.104 0.478 . . . . 0.0 112.048 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.666 HD23 ' HG ' ' A' ' 104' ' ' LEU . 91.1 mt -103.8 166.02 10.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.707 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -87.07 34.74 3.53 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.898 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.6 tp -92.11 114.74 27.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.517 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 21.7 ttm-85 -104.19 126.99 51.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -168.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.452 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 16.2 t70 -142.24 101.05 3.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.896 168.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.517 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 0.4 OUTLIER -102.18 137.08 40.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.68 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.67 7.17 6.12 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.011 177.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.452 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 69.07 95.94 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.297 0.57 . . . . 0.0 111.448 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -118.68 -35.73 3.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.78 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.62 -4.28 79.27 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.757 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -93.11 100.91 13.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.391 0.615 . . . . 0.0 110.363 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -71.73 112.09 7.54 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.151 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -135.71 141.77 44.95 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.615 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 93.9 m95 -78.86 156.92 28.46 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.891 176.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 p -56.9 -45.18 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.36 -174.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 7.5 t70 -94.03 -158.06 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.418 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 6.4 tt0 -81.83 67.8 7.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.187 0.517 . . . . 0.0 110.118 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.615 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 13.1 m -130.29 113.05 16.96 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-O 121.305 0.574 . . . . 0.0 110.099 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -69.04 154.43 70.59 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.443 2.762 . . . . 0.0 112.025 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.495 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 85.0 t80 -78.16 133.06 37.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.432 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 27.9 m-80 -102.33 104.22 35.94 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.766 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -64.79 -33.62 52.93 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.838 2.359 . . . . 0.0 112.289 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -80.07 -18.31 50.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.057 0.456 . . . . 0.0 110.738 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.432 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 82.8 mtt180 -119.28 37.66 4.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.092 0.472 . . . . 0.0 110.995 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.521 HG21 ' CZ3' ' A' ' 113' ' ' TRP . 14.8 p -93.56 127.93 45.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.432 174.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -110.37 72.14 0.78 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.929 0.395 . . . . 0.0 111.117 -173.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -71.4 174.8 6.07 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.428 0.632 . . . . 0.0 111.423 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.526 ' HE2' HG13 ' A' ' 105' ' ' VAL . 24.9 m-70 . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 171.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.0 t30 . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.131 0.491 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.2 p -123.24 137.53 54.85 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.968 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.619 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 32.0 m -86.55 148.59 4.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.345 0.593 . . . . 0.0 111.71 -175.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.728 HG11 ' HA ' ' A' ' 61' ' ' PHE . 33.4 m -122.06 153.66 26.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.401 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.666 ' HG ' HD23 ' A' ' 62' ' ' LEU . 19.1 mt -83.52 106.45 15.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.526 HG13 ' HE2' ' A' ' 89' ' ' HIS . 7.3 p -125.79 146.2 31.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.442 -177.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.608 ' CE1' ' HA ' ' A' ' 109' ' ' ASP . 86.2 t80 -87.93 109.08 19.53 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.79 -177.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.525 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 19.0 m120 -140.77 127.01 19.71 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 63.21 37.85 10.93 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.42 0.629 . . . . 0.0 109.896 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.608 ' HA ' ' CE1' ' A' ' 106' ' ' TYR . 9.3 t70 73.68 -17.47 0.44 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.117 -1.402 . . . . 0.0 111.959 178.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.631 ' HZ2' ' HB3' ' A' ' 112' ' ' ALA . 6.2 pttp -102.22 142.09 34.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.494 0.664 . . . . 0.0 111.029 -175.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -84.35 135.6 34.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.421 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.631 ' HB3' ' HZ2' ' A' ' 110' ' ' LYS . . . -157.12 165.93 34.65 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.228 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.619 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 20.3 m0 -76.52 123.77 26.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.446 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.467 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 4.6 t30 -111.74 123.62 50.63 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -67.71 123.29 20.09 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.515 0.509 . . . . 0.0 109.871 177.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.481 ' CG2' ' HD2' ' A' ' 117' ' ' PRO . 4.1 p -144.47 146.56 33.13 Favored Pre-proline 0 C--N 1.32 -0.709 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.481 ' HD2' ' CG2' ' A' ' 116' ' ' VAL . 11.6 Cg_endo -57.12 133.29 56.73 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.932 1.754 . . . . 0.0 111.324 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 85.0 m -64.39 -9.36 17.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -96.68 22.64 7.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.03 0.443 . . . . 0.0 110.719 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.484 ' O ' ' HA ' ' A' ' 23' ' ' THR . 74.1 t80 -99.76 128.04 45.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.698 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.663 ' OE2' HG22 ' A' ' 23' ' ' THR . 45.1 mm-40 -73.67 123.22 23.65 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -152.05 178.99 8.87 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.1 m -72.96 168.77 18.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -148.19 150.27 33.45 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.998 0.428 . . . . 0.0 112.003 -170.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.745 HG13 ' HB3' ' A' ' 60' ' ' TYR . 54.6 mt -116.91 125.15 73.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.271 173.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.7 t -103.25 126.61 50.5 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -128.9 127.23 41.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.768 -171.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.499 ' HB ' ' CB ' ' A' ' 36' ' ' ALA . 11.8 tt -132.15 141.97 43.34 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.58 157.26 62.6 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 121.942 1.761 . . . . 0.0 110.864 171.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.36 58.03 2.85 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.215 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.3 t -87.03 19.31 3.12 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.125 0.57 . . . . 0.0 110.914 -174.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -28.79 58.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.266 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.5 mt -70.18 -31.7 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.491 . . . . 0.0 110.619 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.01 -39.74 14.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.307 0.575 . . . . 0.0 110.121 177.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 138' ' ' LEU . . . -89.83 38.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.728 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.2 -46.86 79.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.729 0.3 . . . . 0.0 111.576 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 57.1 t30 -75.22 -30.01 60.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.454 -177.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 135' ' ' ALA . 6.9 tt -64.64 -48.19 75.74 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -70.26 -20.66 63.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.274 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -75.2 -32.25 61.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.508 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 78.3 mm-40 -87.39 -6.4 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.93 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.998 -176.434 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 7' ' ' TRP . 6.0 p . . . . . 0 N--CA 1.449 -0.482 0 CA-C-O 121.099 0.476 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 3' ' ' CYS . 44.3 Cg_endo -68.4 171.13 13.43 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.135 2.557 . . . . 0.0 111.292 174.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 35.7 mt -70.44 70.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.539 0.685 . . . . 0.0 111.184 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -166.96 -42.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 37.3 m95 -62.41 119.31 8.86 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 164.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -72.43 109.22 5.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.915 0.388 . . . . 0.0 110.783 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.99 121.48 25.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.251 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.601 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 85.5 t80 -139.15 129.87 26.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.446 ' HG3' ' CD2' ' A' ' 10' ' ' PHE . 52.0 mt-30 66.03 -82.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.697 0.623 . . . . 0.0 110.345 -175.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -152.19 8.64 0.48 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.742 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.402 ' OD1' ' HA ' ' A' ' 129' ' ' PRO . 60.5 m-80 -116.98 166.64 11.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.405 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.731 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 4.1 m -118.03 127.49 53.86 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.601 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 35.7 m-85 -122.52 133.13 54.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.497 0.189 . . . . 0.0 111.034 -174.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.408 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 52.5 t80 -140.34 117.35 8.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.857 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.1 Cg_endo -84.22 137.43 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.376 2.717 . . . . 0.0 112.105 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.463 HD22 ' NH2' ' A' ' 124' ' ' ARG . 3.8 mp -129.44 140.01 51.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.1 p -101.65 21.94 13.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.947 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.52 149.18 50.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.498 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -83.27 97.67 9.0 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 170.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -143.79 145.91 32.71 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.068 0.461 . . . . 0.0 111.065 -172.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.0 p -80.78 173.78 12.27 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.708 173.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.472 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 9.6 t90 -65.25 -35.91 82.48 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -64.0 -48.9 74.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.832 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -62.93 -44.11 96.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.246 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.403 ' HB2' HD12 ' A' ' 38' ' ' LEU . 10.9 p -65.13 -33.1 75.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.647 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.481 ' HA ' HD23 ' A' ' 38' ' ' LEU . 27.2 tt0 -61.57 -37.82 85.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 174.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.587 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 15.6 mmm180 -84.49 -36.81 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.403 -176.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -74.0 -37.92 64.26 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.122 0.487 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 32' ' ' SER . 35.5 m -84.81 177.23 8.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 169.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.733 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 18.8 m 75.77 -48.48 0.6 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.497 0.319 . . . . 0.0 110.594 -175.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.88 -30.68 73.65 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 121.288 -0.482 . . . . 0.0 112.229 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 77.7 mtm -80.32 4.16 18.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.984 0.421 . . . . 0.0 110.788 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.72 51.76 7.76 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.733 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -147.02 -175.49 4.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.086 -0.557 . . . . 0.0 109.91 -173.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -149.29 170.43 18.53 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 175.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 28' ' ' GLU . 4.2 mm? -63.59 157.6 23.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.837 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -61.55 96.41 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.394 0.616 . . . . 0.0 111.586 -177.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.35 98.34 8.72 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.466 176.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.593 HG12 ' HE1' ' A' ' 39' ' ' MET . 52.8 mt -64.6 115.51 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.669 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 -28.13 16.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.103 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.612 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 25.5 p -141.38 154.91 45.91 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.532 0.682 . . . . 0.0 111.652 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.41 -37.49 83.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.204 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.401 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -59.82 -41.44 91.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.115 0.484 . . . . 0.0 109.999 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.612 ' HB3' ' O ' ' A' ' 43' ' ' THR . 70.3 tt0 -51.5 -51.99 50.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.593 174.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -58.08 -50.4 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.068 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -56.8 -30.85 64.1 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.234 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.401 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 36.6 m-85 -88.53 -39.31 14.25 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.07 -28.56 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.377 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.478 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.9 pt -70.3 -8.8 11.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.963 0.411 . . . . 0.0 111.403 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.4 HE21 ' HA ' ' A' ' 49' ' ' PHE . 50.2 mt-30 -87.68 -18.21 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.308 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -93.03 -20.25 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.068 176.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 82.3 mt -81.84 130.27 35.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.994 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.533 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.3 t70 -64.5 136.61 57.23 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 172.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.474 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 84.9 mtt180 -86.99 15.97 5.44 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -169.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.611 ' HG2' HD22 ' A' ' 58' ' ' LEU . 9.8 ptp85 -113.62 -11.99 12.92 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.304 -0.559 . . . . 0.0 111.083 174.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.611 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.3 mm? -99.24 164.56 12.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.284 0.564 . . . . 0.0 111.717 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -120.63 114.4 21.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.254 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.631 ' HB3' HG13 ' A' ' 125' ' ' ILE . 47.7 m-85 -102.51 126.62 49.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.587 0.218 . . . . 0.0 111.587 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.774 ' HA ' HG12 ' A' ' 103' ' ' VAL . 33.2 m-85 -62.14 139.87 58.45 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.962 0.41 . . . . 0.0 111.707 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.47 HD22 ' HG ' ' A' ' 104' ' ' LEU . 73.5 mt -105.02 158.56 16.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.145 175.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -83.2 53.89 4.91 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 114.461 0.544 . . . . 0.0 114.461 -170.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 75' ' ' TRP . 2.3 pt? -135.36 150.24 49.89 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -153.35 144.32 22.87 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.433 0.635 . . . . 0.0 111.401 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.787 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 30.7 t70 -107.98 93.57 4.61 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 162.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.56 ' CD ' ' HZ3' ' A' ' 70' ' ' LYS . 3.4 tm-20 -64.97 112.74 3.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.87 -167.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 52.99 34.8 17.77 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.642 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 66.79 92.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.617 0.723 . . . . 0.0 112.046 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HZ3' ' CD ' ' A' ' 67' ' ' GLU . 41.3 mttp -126.13 -13.52 6.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 177.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.01 19.73 79.78 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.099 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.79 93.74 4.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.477 0.656 . . . . 0.0 110.706 -178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -71.8 103.24 3.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.541 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -147.92 155.62 41.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.821 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.565 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 80.0 m95 -81.93 168.6 17.73 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 176.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.09 -34.22 67.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -116.09 79.23 1.28 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 70.79 -50.0 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.066 173.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.443 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 18.7 m -47.41 124.1 9.07 Favored Pre-proline 0 C--N 1.329 -0.322 0 C-N-CA 123.361 0.665 . . . . 0.0 112.548 -170.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.4 Cg_exo -71.63 153.55 59.8 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 123.168 2.579 . . . . 0.0 111.625 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.489 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 87.4 t80 -61.52 147.06 46.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.366 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.478 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 50.6 m-80 -98.8 100.04 8.9 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.844 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 74.0 Cg_endo -79.65 -24.95 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.355 2.037 . . . . 0.0 112.011 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -91.16 -7.79 50.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.134 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.478 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 78.4 mtm180 -134.59 44.97 2.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.12 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 p -95.28 131.55 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.143 0.497 . . . . 0.0 109.839 177.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -115.65 74.5 0.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -175.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -75.12 -179.52 4.42 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.672 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 90.9 m-70 . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.405 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.787 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 3.1 t-20 . . . . . 0 N--CA 1.453 -0.291 0 CA-C-O 120.726 0.298 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.7 p -157.0 166.1 34.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.273 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.537 HG21 HD21 ' A' ' 64' ' ' LEU . 1.3 m -115.96 153.86 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.888 -176.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.774 HG12 ' HA ' ' A' ' 61' ' ' PHE . 23.1 m -124.88 153.47 31.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.132 177.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.47 ' HG ' HD22 ' A' ' 62' ' ' LEU . 23.4 mt -84.55 109.67 18.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 171.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.0 143.24 41.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.562 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -84.25 102.42 12.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.446 177.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.672 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 19.3 t-20 -147.47 136.73 22.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.668 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.468 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 25.3 mt-30 69.94 31.81 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.994 0.808 . . . . 0.0 109.092 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 t0 63.52 22.11 13.05 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.362 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.61 152.76 40.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.66 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.478 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -77.54 138.4 39.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.53 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . . . -166.99 165.62 15.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.621 0.248 . . . . 0.0 110.95 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -77.74 135.31 38.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.55 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -125.36 135.85 52.85 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -73.31 124.7 26.22 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 123.388 0.43 . . . . 0.0 110.393 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.1 m -143.52 156.42 60.17 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.893 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -67.5 132.18 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.237 1.958 . . . . 0.0 110.907 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 81.9 m -62.37 -21.56 65.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.932 0.396 . . . . 0.0 111.309 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -94.93 64.37 2.83 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.496 0.665 . . . . 0.0 110.099 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -140.65 139.91 34.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.21 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -78.3 110.83 13.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.143 0.497 . . . . 0.0 111.22 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.47 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -147.76 179.09 7.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.457 175.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 p -80.54 174.59 11.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.784 0.326 . . . . 0.0 110.402 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.463 ' NH2' HD22 ' A' ' 18' ' ' LEU . 19.1 ptt180 -144.96 156.35 43.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.039 0.447 . . . . 0.0 111.564 -171.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.837 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 30.6 mt -122.41 131.62 72.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.04 124.22 48.1 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 19.7 tptm -112.28 111.75 22.85 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.504 -172.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.731 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 38.1 mt -96.85 124.35 50.41 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.553 174.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 131' ' ' THR . 40.3 Cg_endo -69.07 168.74 19.78 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.673 2.249 . . . . 0.0 111.279 177.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.59 37.69 0.1 OUTLIER Glycine 0 CA--C 1.526 0.754 0 N-CA-C 114.497 0.559 . . . . 0.0 114.497 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 129' ' ' PRO . 7.2 t -77.54 -17.53 57.84 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.0 m -62.93 -30.45 71.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.941 173.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.45 -29.17 61.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.479 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -79.68 -29.2 40.74 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.569 0.699 . . . . 0.0 109.631 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.608 ' HB2' ' HB3' ' A' ' 138' ' ' LEU . . . -89.96 44.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.338 176.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.67 -55.02 34.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.898 -175.463 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.5 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 7.5 m-80 -71.84 -27.16 62.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.049 0.452 . . . . 0.0 110.221 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.608 ' HB3' ' HB2' ' A' ' 135' ' ' ALA . 3.1 tm? -60.35 -47.52 85.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.535 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -75.39 -28.12 59.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.571 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . 0.45 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 85.2 t80 -63.36 -25.76 68.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.1 mt-30 -79.24 -8.6 59.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.592 178.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.867 -177.567 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.484 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 73.6 m . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.566 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 51.4 Cg_exo -53.71 160.88 4.98 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.473 2.115 . . . . 0.0 112.439 176.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.514 HD11 ' H ' ' A' ' 5' ' ' ILE . 3.5 mp -58.92 135.11 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.814 -174.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 81.4 -18.51 0.48 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.375 1.07 . . . . 0.0 112.383 173.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.566 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 28.4 m95 -58.97 121.11 10.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.459 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 5.2 mpt_? -72.96 103.28 3.71 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.371 -175.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.14 120.85 21.21 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.443 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -128.24 104.77 7.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 61.44 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.612 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -110.63 -37.27 5.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.562 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -101.89 173.25 6.49 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.745 -170.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.555 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 58.0 m -135.57 131.28 35.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.474 ' CE2' ' HB3' ' A' ' 127' ' ' LYS . 69.6 m-85 -118.25 126.14 51.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.815 0.341 . . . . 0.0 111.809 -172.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.472 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 67.0 t80 -111.99 119.61 43.9 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.946 177.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.3 Cg_endo -85.65 134.23 4.64 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.2 2.6 . . . . 0.0 112.184 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 138.66 54.6 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.85 0.357 . . . . 0.0 110.179 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 p -88.68 -4.76 58.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.261 0.553 . . . . 0.0 109.916 174.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 t70 -56.0 139.06 47.81 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.356 178.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.433 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 13.6 m120 -92.82 105.35 17.5 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.644 ' HB2' ' HZ1' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -139.19 154.08 48.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.775 -178.443 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.49 ' OG1' ' HG2' ' A' ' 26' ' ' GLU . 57.4 p -80.11 168.59 18.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.408 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 23.4 t90 -59.92 -39.83 86.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.041 0.448 . . . . 0.0 110.41 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.12 -48.7 50.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.354 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HB2' ' HG3' ' A' ' 22' ' ' LYS . 12.0 mm-40 -69.38 -28.81 66.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.673 0.273 . . . . 0.0 110.821 -177.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.536 ' HB3' HD21 ' A' ' 38' ' ' LEU . 73.2 m -57.94 -45.68 86.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.985 173.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.483 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 6.6 mm-40 -74.78 -18.77 60.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 177.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -73.84 -35.31 64.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.802 0.334 . . . . 0.0 110.923 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.15 -38.91 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.525 0.679 . . . . 0.0 110.022 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.3 m -87.49 179.15 6.61 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.97 174.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.791 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 62.0 m 73.59 -43.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.482 0.313 . . . . 0.0 111.496 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.12 -22.94 65.57 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.907 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mtm -87.51 12.47 12.26 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.162 0.185 . . . . 0.0 110.768 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.448 ' O ' HG13 ' A' ' 128' ' ' ILE . . . 72.61 38.93 57.07 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -172.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.791 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -134.02 -174.27 3.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.949 -0.626 . . . . 0.0 110.512 -171.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.31 168.08 27.29 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 176.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' A' ' 27' ' ' SER . 41.2 mt -64.79 146.79 54.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.378 0.535 . . . . 0.0 110.799 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.733 ' HE3' HG12 ' A' ' 41' ' ' ILE . 23.5 ttt -59.05 126.13 26.43 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 121.451 0.643 . . . . 0.0 111.972 -176.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.504 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 33.4 p -118.72 106.96 13.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.717 173.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.733 HG12 ' HE3' ' A' ' 39' ' ' MET . 48.6 mt -58.5 104.23 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.733 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.8 m -89.7 -31.36 17.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.789 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.457 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 27.3 p -137.42 152.35 49.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.531 0.682 . . . . 0.0 111.604 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.17 -43.41 98.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.688 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -60.59 -37.15 80.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.497 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 43' ' ' THR . 40.1 tt0 -55.05 -51.39 66.48 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.386 177.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.476 ' HA ' HG21 ' A' ' 50' ' ' ILE . 48.1 tt0 -60.03 -47.34 86.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.695 176.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -57.34 -35.26 69.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.889 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.656 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 35.8 m-85 -84.4 -29.2 26.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.4 tp -78.62 -31.1 15.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.047 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.408 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 32.5 pt -72.48 -4.38 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -176.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.656 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 2.7 pt20 -87.88 -20.42 26.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 175.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -94.38 -30.14 14.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 81.9 mt -71.09 144.19 50.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.559 -176.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.508 ' HB3' HD21 ' A' ' 58' ' ' LEU . 13.5 t70 -76.06 131.85 39.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.381 176.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.569 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 76.7 mtt180 -84.43 27.47 0.7 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -170.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.805 ' HG2' HD23 ' A' ' 58' ' ' LEU . 3.0 ptp180 -126.95 -13.78 5.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.699 0.285 . . . . 0.0 110.848 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.805 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -97.66 157.57 15.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.039 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 p -108.96 115.55 30.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.682 174.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.589 ' HB3' HG13 ' A' ' 125' ' ' ILE . 96.2 m-85 -99.55 123.86 44.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.587 ' HA ' HG11 ' A' ' 103' ' ' VAL . 8.2 m-85 -61.39 139.06 58.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.997 0.427 . . . . 0.0 111.824 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.5 mt -114.42 175.49 5.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.145 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.08 -2.37 90.43 Favored Glycine 0 CA--C 1.521 0.468 0 C-N-CA 120.903 -0.665 . . . . 0.0 114.407 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.467 ' HB2' HG22 ' A' ' 102' ' ' VAL . 15.0 mt -79.68 127.48 32.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.809 0.804 . . . . 0.0 110.742 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HG3' ' SG ' ' A' ' 101' ' ' CYS . 35.0 ttt180 -137.63 129.02 28.03 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -94.5 147.27 23.43 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 161.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.03 26.77 1.33 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.456 ' HB2' ' HZ2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -179.54 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.249 179.511 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.59 32.33 21.68 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -167.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.456 ' HZ2' ' HB2' ' A' ' 68' ' ' ASN . 2.9 ptpp? -85.26 -19.42 31.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.741 -173.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.32 5.71 59.96 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.397 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -86.58 82.93 7.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.441 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 98.7 m95 -69.34 105.88 2.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.362 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -126.43 146.0 50.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.729 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.543 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 76.5 m95 -84.91 139.56 31.76 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.47 -11.8 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.142 0.496 . . . . 0.0 111.689 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.48 ' HB3' HG21 ' A' ' 40' ' ' THR . 32.6 t70 -99.41 29.24 4.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.306 0.574 . . . . 0.0 109.989 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.36 -12.31 0.73 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.33 177.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.543 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.3 m -59.38 131.33 87.83 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.113 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.97 159.51 44.61 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.889 2.393 . . . . 0.0 112.044 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 52.6 t80 -71.29 139.0 49.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.559 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -90.46 114.76 62.27 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.109 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.511 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.8 Cg_exo -74.7 -12.32 22.17 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.115 2.543 . . . . 0.0 112.899 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -123.89 -43.99 2.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.881 0.372 . . . . 0.0 110.764 178.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -84.05 52.22 2.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 109.842 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.5 p -98.21 -33.56 4.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.567 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 68.44 -65.19 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.424 0.689 . . . . 0.0 112.67 172.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 39.7 m95 53.89 -169.06 0.06 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.534 ' HA ' ' HB2' ' A' ' 112' ' ' ALA . 1.5 t-80 . . . . . 0 N--CA 1.449 -0.51 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.896 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.255 0.55 . . . . 0.0 109.917 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.514 ' SG ' ' HG3' ' A' ' 65' ' ' ARG . 29.8 m -103.5 136.47 43.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 26.8 m -93.25 138.78 19.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.152 0.501 . . . . 0.0 110.961 -179.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.587 HG11 ' HA ' ' A' ' 61' ' ' PHE . 21.5 m -116.26 147.5 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.712 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.421 ' HG ' ' CE3' ' A' ' 111' ' ' TRP . 22.6 tp -83.18 101.88 11.5 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -124.76 141.23 45.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.063 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.569 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 38.0 t80 -86.34 99.32 11.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.505 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -142.32 136.74 29.99 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 66.22 28.14 10.11 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -171.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.2 t70 72.0 -3.04 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.694 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.443 ' HE3' ' HB3' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -113.45 143.31 44.72 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.787 -0.57 . . . . 0.0 110.964 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.421 ' CE3' ' HG ' ' A' ' 104' ' ' LEU . 93.4 m95 -69.28 130.19 41.91 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 169.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.534 ' HB2' ' HA ' ' A' ' 89' ' ' HIS . . . -149.58 166.54 28.95 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.029 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.623 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 42.9 m0 -96.37 119.36 34.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.264 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.44 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 1.8 t30 -104.45 146.16 29.25 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.86 136.38 40.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.4 HG11 ' O ' ' A' ' 101' ' ' CYS . 4.5 p -158.67 143.84 11.91 Favored Pre-proline 0 C--N 1.317 -0.806 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.2 129.09 29.74 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.058 1.839 . . . . 0.0 110.609 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.1 m -57.44 -28.21 63.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.219 0.533 . . . . 0.0 110.261 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -90.85 70.66 6.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 170.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.446 ' O ' ' HA ' ' A' ' 23' ' ' THR . 83.9 t80 -138.14 133.69 33.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.528 175.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 28.2 mp0 -74.62 109.72 8.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.052 0.453 . . . . 0.0 110.629 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -142.84 179.62 6.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.027 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 48.9 m -74.35 168.47 19.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -137.06 147.82 46.39 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.695 -167.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.589 HG13 ' HB3' ' A' ' 60' ' ' TYR . 50.3 mt -132.23 122.23 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 168.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 82.4 m -118.09 143.54 46.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.221 0.534 . . . . 0.0 111.279 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.474 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 22.2 ptmt -112.97 143.02 44.98 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.5 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.555 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 10.0 tt -118.57 136.26 24.03 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.406 ' HG2' HG21 ' A' ' 131' ' ' THR . 19.3 Cg_endo -59.91 166.95 7.77 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.472 2.115 . . . . 0.0 111.96 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.456 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -44.14 -39.76 5.45 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.552 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.406 HG21 ' HG2' ' A' ' 129' ' ' PRO . 7.7 p 58.98 -12.07 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 173.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 24.2 p -58.91 -51.77 68.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.601 0.239 . . . . 0.0 110.648 177.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.6 mt -54.26 -24.33 18.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.739 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -87.1 -52.17 5.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.231 0.539 . . . . 0.0 110.229 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.01 22.48 3.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.49 -175.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 132' ' ' THR . 60.2 mm-40 -48.83 -66.14 0.45 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.067 0.46 . . . . 0.0 111.685 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 92.4 m-20 -74.72 -27.51 60.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.0 -46.22 90.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.76 -24.43 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . 0.407 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 86.5 t80 -67.15 -24.91 65.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 23.7 mt-30 -85.24 -5.19 59.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.439 178.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.831 -177.721 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 m . . . . . 0 C--O 1.234 0.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.701 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 44.4 Cg_exo -56.66 163.32 7.21 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.221 1.947 . . . . 0.0 112.007 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.4 tp -56.87 122.15 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.3 t70 66.37 6.18 4.16 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.83 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.701 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 14.5 m95 -63.27 122.95 17.43 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 170.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.558 ' HB3' ' HB2' ' A' ' 15' ' ' TYR . 4.8 tpp180 -72.24 97.59 2.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.015 -165.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -76.42 121.78 23.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.051 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.405 ' HB3' ' OD1' ' A' ' 13' ' ' ASN . 85.1 t80 -132.2 102.21 5.69 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.864 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 67.68 -71.59 0.1 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.196 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -145.88 13.53 1.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.754 0.311 . . . . 0.0 111.47 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 26.0 p30 -132.29 169.26 16.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.437 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 92.6 m -139.77 133.87 31.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.965 0.412 . . . . 0.0 110.012 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.799 ' HE2' ' HG2' ' A' ' 39' ' ' MET . 45.4 m-85 -115.03 142.52 46.52 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -170.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -127.72 113.23 20.72 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.003 169.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -89.92 122.95 1.1 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.095 2.53 . . . . 0.0 112.148 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.476 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.6 mp -112.94 138.8 49.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.903 0.382 . . . . 0.0 110.099 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.428 HG22 ' HH ' ' A' ' 60' ' ' TYR . 19.8 p -105.65 9.5 33.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.497 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -82.38 136.29 35.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.973 0.416 . . . . 0.0 110.015 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.782 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 16.2 m120 -71.49 100.32 2.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.422 -176.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.526 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 21.2 mmmt -127.24 149.66 49.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.386 177.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 61.7 p -75.21 165.58 24.98 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.412 ' CZ3' ' HD2' ' A' ' 65' ' ' ARG . 68.4 t90 -56.81 -39.04 73.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.114 0.483 . . . . 0.0 110.276 -179.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -63.66 -50.88 67.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.91 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -64.84 -36.83 85.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.157 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.1 t -51.35 -47.82 62.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.189 174.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -74.82 -21.07 59.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.175 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 34.1 mmt-85 -82.7 -32.66 27.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.703 0.287 . . . . 0.0 111.339 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -83.32 -38.82 21.58 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.107 0.479 . . . . 0.0 109.916 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.547 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 96.8 m -85.68 177.8 7.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.798 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.509 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 35.7 m 76.88 -33.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.812 0.845 . . . . 0.0 110.511 -172.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 31' ' ' CYS . . . -62.84 -32.75 84.91 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.394 -0.431 . . . . 0.0 112.471 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 pmm? -95.25 1.63 54.63 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.956 0.378 . . . . 0.0 110.448 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.03 -6.41 66.62 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.791 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.476 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.02 140.16 30.35 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.488 ' HD2' ' OD2' ' A' ' 77' ' ' ASP . 33.0 t60 -118.66 165.51 13.89 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.04 133.96 8.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.988 0.423 . . . . 0.0 111.552 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.799 ' HG2' ' HE2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -58.54 103.73 0.17 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.492 0.663 . . . . 0.0 111.03 178.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.64 ' HA ' ' HZ3' ' A' ' 75' ' ' TRP . 2.0 t -94.3 118.91 32.3 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.412 168.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.562 HD11 ' CE ' ' A' ' 39' ' ' MET . 25.3 mm -61.3 119.95 6.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.4 m -102.75 -45.45 5.0 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.0 p -136.98 163.08 31.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 111.244 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -64.88 -40.56 95.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.052 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.41 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.47 -45.48 90.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.195 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -54.15 -50.45 66.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.726 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -51.7 -50.36 60.65 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.638 176.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -66.26 -41.43 89.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.951 -177.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.41 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 26.1 m-85 -70.19 -41.29 73.89 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.3 tp -69.96 -34.07 58.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.548 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.428 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 33.8 pt -71.91 -3.26 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 120.885 0.374 . . . . 0.0 111.349 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -87.46 -23.96 24.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.405 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 72.9 m-85 -93.14 -21.21 19.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -73.89 142.48 46.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.501 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 15.1 t70 -67.97 119.61 12.9 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.434 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.3 mtt180 -71.33 60.61 0.3 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.449 0.468 . . . . 0.0 111.742 -177.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.501 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 1.9 ttp180 -162.54 -29.32 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.293 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.443 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -92.35 173.98 7.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.381 0.61 . . . . 0.0 111.948 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.6 p -122.0 129.51 52.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.145 174.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.663 ' HB3' HG13 ' A' ' 125' ' ' ILE . 68.0 m-85 -114.17 126.23 54.83 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 -173.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.616 ' HA ' HG13 ' A' ' 103' ' ' VAL . 38.7 m-85 -61.98 146.94 48.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.1 mt -113.64 176.77 4.89 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.468 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.92 6.18 67.59 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 115.764 1.066 . . . . 0.0 115.764 -169.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.667 ' H ' HD22 ' A' ' 64' ' ' LEU . 1.4 pt? -103.48 138.54 40.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 118.861 1.331 . . . . 0.0 110.894 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.412 ' HD2' ' CZ3' ' A' ' 24' ' ' TRP . 30.3 ttt180 -136.86 137.81 40.09 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.672 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 7.6 t0 -109.82 154.22 23.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 161.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 2.9 pt-20 -145.02 -1.79 0.83 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -167.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -157.32 26.22 0.3 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.96 45.76 20.68 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.52 0.676 . . . . 0.0 109.229 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.672 ' HE2' ' HA ' ' A' ' 66' ' ' ASP . 35.9 mtmt -70.04 -47.29 62.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.104 -173.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.24 -26.76 8.35 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -173.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -89.14 100.06 12.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.092 -0.554 . . . . 0.0 109.615 176.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.521 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 92.1 m95 -70.97 142.83 51.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.579 0.704 . . . . 0.0 112.089 -175.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -140.47 120.12 13.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.699 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.64 ' HZ3' ' HA ' ' A' ' 40' ' ' THR . 40.7 m95 -79.15 147.21 32.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.912 175.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.424 HG22 ' HE2' ' A' ' 37' ' ' HIS . 11.2 p -75.01 -13.21 15.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.504 0.669 . . . . 0.0 109.996 178.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.513 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 4.6 m-20 -90.07 18.99 5.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.049 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.513 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 47.1 tp60 76.53 -19.72 0.4 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.231 0.612 . . . . 0.0 111.403 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.403 ' H ' ' C ' ' A' ' 77' ' ' ASP . 10.9 m -55.73 127.42 67.41 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 120.986 0.422 . . . . 0.0 111.556 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -72.55 158.94 50.08 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.532 2.155 . . . . 0.0 110.464 170.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.521 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 64.0 t80 -64.49 117.88 7.97 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.685 -178.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.565 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -90.72 110.79 43.96 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.706 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.99 -20.69 33.44 Favored 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.521 2.147 . . . . 0.0 112.444 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -104.55 2.88 31.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.523 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 3.6 mmp_? -123.2 22.48 9.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.116 0.484 . . . . 0.0 110.001 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.476 HG22 ' CZ3' ' A' ' 113' ' ' TRP . 14.6 p -99.52 140.75 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.174 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -124.15 74.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.82 0.343 . . . . 0.0 110.735 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -63.5 156.55 25.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.223 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.593 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 27.1 t-80 . . . . . 0 C--O 1.235 0.324 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.535 -172.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.8 t30 . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.143 0.497 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.507 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.439 ' CG2' HD23 ' A' ' 64' ' ' LEU . 2.1 m -88.74 147.7 5.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.218 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.616 HG13 ' HA ' ' A' ' 61' ' ' PHE . 29.0 m -127.43 154.47 37.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.639 176.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.9 mt -82.87 102.96 11.99 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 170.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.33 142.29 22.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.802 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -91.33 114.29 26.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.741 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.521 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -151.3 122.55 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.055 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 110' ' ' LYS . 50.0 mt-30 61.31 47.41 6.95 Favored 'General case' 0 CA--C 1.518 -0.264 0 O-C-N 123.981 0.8 . . . . 0.0 110.017 -176.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 t70 73.44 -28.3 0.19 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.936 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 108' ' ' GLN . 14.2 ptmm? -97.7 130.31 44.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.78 0.8 . . . . 0.0 112.383 -171.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.434 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 88.1 m95 -79.42 148.81 31.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.462 171.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -177.09 177.15 1.29 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.394 0.434 . . . . 0.0 111.012 173.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.476 ' CZ3' HG22 ' A' ' 86' ' ' VAL . 8.9 m0 -78.97 134.74 36.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.936 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -136.19 137.65 41.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -79.89 125.04 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.043 0.449 . . . . 0.0 111.343 -177.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.462 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 23.0 m -143.91 160.12 51.0 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.643 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 15.9 Cg_endo -58.58 140.36 94.45 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.096 1.864 . . . . 0.0 111.365 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.02 -23.71 61.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.808 0.337 . . . . 0.0 110.497 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -94.66 53.21 1.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.53 0.681 . . . . 0.0 110.273 174.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.549 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 66.8 t80 -123.64 125.64 45.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.309 176.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.782 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 1.8 mp0 -68.75 109.3 3.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.974 0.416 . . . . 0.0 110.98 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.441 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -142.52 -177.94 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.877 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 37.9 m -80.53 172.21 14.05 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.789 0.328 . . . . 0.0 110.347 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.476 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 12.3 ptt180 -149.65 148.98 29.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.128 0.49 . . . . 0.0 112.101 -171.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.663 HG13 ' HB3' ' A' ' 60' ' ' TYR . 19.2 mt -119.79 121.55 66.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 173.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 87.5 m -112.62 126.32 55.24 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.265 0.555 . . . . 0.0 110.119 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.527 ' HG2' ' HA ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -112.16 124.93 53.5 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.471 -173.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.476 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 18.4 tt -106.8 144.2 28.59 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.896 -178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.463 ' HD2' HG13 ' A' ' 128' ' ' ILE . 7.9 Cg_endo -54.97 166.03 2.36 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.796 2.331 . . . . 0.0 112.503 172.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -64.53 89.97 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.548 173.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.6 p -61.21 2.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.491 ' H ' ' C ' ' A' ' 130' ' ' GLY . 15.1 t -75.18 -5.1 42.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.618 179.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.4 mp -85.26 -26.31 26.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.701 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -88.91 -50.32 6.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.5 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -92.45 35.46 1.02 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.347 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.702 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -72.36 -67.99 0.51 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.443 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.702 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 3.8 p30 -86.81 -22.57 25.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 5.4 tt -55.64 -55.72 28.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -75.0 -19.76 59.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.216 0.531 . . . . 0.0 109.964 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.87 -31.51 70.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.043 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 81.6 mm-40 -86.19 -38.63 17.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.621 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.105 -177.211 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 C--O 1.233 0.188 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -57.85 152.24 51.43 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.845 1.697 . . . . 0.0 110.979 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 15.4 tt -74.61 -18.72 16.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.069 0.461 . . . . 0.0 111.681 -171.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -74.57 -32.19 62.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.474 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 34.9 m95 -72.67 128.19 34.82 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.494 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 2.0 tpp180 -84.1 121.1 26.97 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.446 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.62 138.76 31.22 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.113 0.482 . . . . 0.0 111.972 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CB ' ' HE1' ' A' ' 15' ' ' TYR . 84.5 t80 -131.53 102.44 5.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 58.78 -96.51 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.707 -174.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.0 t -105.81 -12.08 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.691 -178.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -93.54 164.49 13.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.697 0.284 . . . . 0.0 111.356 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.9 m -144.12 131.52 20.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.229 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.426 ' HE1' ' CB ' ' A' ' 10' ' ' PHE . 2.9 m-85 -123.5 134.77 53.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 -175.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.474 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 34.5 t80 -124.62 115.43 26.8 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 174.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -82.57 120.19 3.13 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.13 2.553 . . . . 0.0 112.24 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -99.29 139.12 35.42 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.995 0.426 . . . . 0.0 110.228 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.0 p -94.43 -3.29 50.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.41 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.421 ' CG ' ' HZ2' ' A' ' 22' ' ' LYS . 3.5 t70 -65.68 135.68 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.912 178.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.19 120.75 29.84 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.1 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 43.1 mmtm -144.25 150.97 38.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.363 177.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.96 158.94 33.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 167.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.421 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 82.5 t90 -52.48 -47.26 66.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.705 0.288 . . . . 0.0 111.358 -175.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.14 93.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.274 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.64 -27.13 63.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.955 0.407 . . . . 0.0 110.816 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.478 ' HG ' HD11 ' A' ' 38' ' ' LEU . 47.8 t -62.52 -43.95 97.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.18 175.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.551 ' OE2' HG12 ' A' ' 76' ' ' VAL . 8.7 tp10 -79.21 -21.39 46.35 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.311 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.32 -31.13 69.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.987 173.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.418 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.5 t-20 -85.41 -28.26 25.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.432 0.634 . . . . 0.0 109.742 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 80.9 m -84.61 -179.9 7.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 170.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 72.5 m 73.56 -45.79 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.755 0.422 . . . . 0.0 111.193 -175.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.08 -27.6 70.74 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.66 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 75.3 mtm -92.74 7.37 43.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.806 0.336 . . . . 0.0 110.472 176.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.69 -6.28 70.47 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.367 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.73 ' HB3' ' HB ' ' A' ' 128' ' ' ILE . . . -96.79 -177.71 3.99 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.538 0.209 . . . . 0.0 111.318 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -148.53 169.76 19.57 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.773 0.429 . . . . 0.0 110.009 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.478 HD11 ' HG ' ' A' ' 27' ' ' SER . 3.7 mm? -55.0 143.65 25.85 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.068 0.23 . . . . 0.0 110.496 173.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.615 ' HE1' HG12 ' A' ' 41' ' ' ILE . 14.3 tpt -49.6 109.6 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.654 0.596 . . . . 0.0 111.884 -177.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.537 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 27.3 p -107.92 106.76 17.17 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.326 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.615 HG12 ' HE1' ' A' ' 39' ' ' MET . 54.9 mt -81.62 116.13 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.932 -176.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.3 p -102.89 -31.56 10.2 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.04 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.6 p -131.16 159.44 37.68 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.522 0.677 . . . . 0.0 111.904 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.428 ' HG3' ' HE ' ' A' ' 85' ' ' ARG . 19.8 mt-10 -68.42 -39.41 81.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.711 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.26 -33.52 74.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.597 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -58.84 -50.35 74.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.164 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.431 ' O ' HG22 ' A' ' 51' ' ' ILE . 34.3 tt0 -57.63 -55.44 34.76 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 35.2 m-80 -59.17 -36.96 76.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.069 -175.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -69.49 -47.22 64.57 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 121.278 -0.169 . . . . 0.0 111.106 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.504 HG21 ' HE3' ' A' ' 39' ' ' MET . 8.8 tp -70.59 -33.98 55.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.011 0.434 . . . . 0.0 111.58 -174.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.791 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.9 pt -71.06 -11.19 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.946 0.403 . . . . 0.0 110.938 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.9 mt-30 -76.91 -27.55 54.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.634 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.44 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 55.1 m-85 -90.14 -21.77 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.596 -179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.43 150.07 40.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.262 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -67.84 -13.48 62.17 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.701 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.577 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 49.5 mtp180 66.84 30.55 7.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.911 0.386 . . . . 0.0 111.099 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' HD21 ' A' ' 58' ' ' LEU . 3.7 ttm180 -132.21 -56.36 0.97 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.832 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.62 HD21 ' HB3' ' A' ' 57' ' ' ARG . 2.7 mm? -83.27 170.96 14.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.453 -174.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -111.82 125.72 54.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.468 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.587 ' HB3' HG13 ' A' ' 125' ' ' ILE . 21.3 m-85 -108.76 126.52 53.11 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -171.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.438 ' HA ' HG11 ' A' ' 103' ' ' VAL . 13.7 m-85 -60.54 149.94 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.745 ' HB2' HG11 ' A' ' 102' ' ' VAL . 90.4 mt -120.91 -178.93 3.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.298 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.53 ' CA ' HG23 ' A' ' 76' ' ' VAL . . . -81.86 -17.94 68.97 Favored Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.749 -0.738 . . . . 0.0 114.193 -176.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.609 ' HB2' ' CG1' ' A' ' 102' ' ' VAL . 83.7 mt -71.78 121.53 19.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 117.666 0.733 . . . . 0.0 110.455 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 ptm85 -129.19 161.76 29.4 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.597 0.713 . . . . 0.0 112.32 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.651 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 1.8 t70 -135.61 151.52 50.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.676 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.982 ' HG2' ' HD2' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -112.07 -33.51 6.23 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -161.42 71.3 0.38 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.251 -172.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.81 36.43 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.041 0.448 . . . . 0.0 111.449 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.982 ' HD2' ' HG2' ' A' ' 67' ' ' GLU . 32.3 mtpt -63.03 127.86 33.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.451 -177.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.65 -14.64 82.21 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.118 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.402 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 4.1 pt20 -107.8 113.64 27.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.276 0.56 . . . . 0.0 110.251 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.535 ' HE3' ' HB3' ' A' ' 64' ' ' LEU . 44.9 m95 -99.33 158.65 15.56 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.779 -178.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.5 ' HG2' ' N ' ' A' ' 75' ' ' TRP . 3.6 ttt180 -152.04 149.38 28.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.537 176.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.537 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 82.4 m95 -82.74 -174.65 5.35 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.568 0.542 . . . . 0.0 109.756 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.551 HG12 ' OE2' ' A' ' 28' ' ' GLU . 35.5 t -81.82 -65.09 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.89 -77.88 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.61 -18.07 0.14 Allowed 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.8 m -57.03 118.24 22.76 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.875 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.33 169.71 20.12 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.042 2.495 . . . . 0.0 111.542 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 77.1 t80 -60.49 137.45 58.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 110.001 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -97.24 118.86 64.14 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.784 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.51 -46.61 20.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.327 2.685 . . . . 0.0 113.879 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -85.5 -31.51 22.72 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.592 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -92.08 80.03 5.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 110.133 -176.256 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.0 t -128.61 103.87 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.507 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -127.35 67.51 1.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.338 -173.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.49 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 86.1 m95 -84.93 -166.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.855 0.359 . . . . 0.0 110.595 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.606 ' CE1' ' HB2' ' A' ' 112' ' ' ALA . 69.1 m-70 . . . . . 0 CA--C 1.514 -0.404 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 66' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--O 1.224 -0.243 0 CA-C-O 121.544 0.688 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.3 m -102.45 139.66 37.77 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.745 HG11 ' HB2' ' A' ' 62' ' ' LEU . 13.8 p -91.53 145.68 7.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -169.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.438 HG11 ' HA ' ' A' ' 61' ' ' PHE . 19.8 m -128.84 155.28 40.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.595 174.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.661 ' HG ' HD13 ' A' ' 62' ' ' LEU . 23.1 mt -88.35 118.92 28.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 171.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -130.37 141.62 45.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.42 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -75.64 108.37 8.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.703 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.428 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.9 t-20 -159.08 143.18 15.3 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -177.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 66.73 35.33 5.19 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.314 0.578 . . . . 0.0 109.748 -173.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.69 4.11 4.85 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 114.548 -1.206 . . . . 0.0 112.691 174.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.5 175.44 10.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.882 0.372 . . . . 0.0 110.288 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.791 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 82.2 m95 -85.69 137.64 32.68 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 173.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.606 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . . . -154.93 174.22 15.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.481 176.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.49 ' HB2' ' HA ' ' A' ' 88' ' ' TRP . 51.9 m0 -81.04 136.5 35.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.522 -172.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -129.93 130.07 44.64 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.112 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.82 123.92 27.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.193 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.24 158.63 63.72 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.529 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.43 135.89 67.51 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.332 2.021 . . . . 0.0 111.018 171.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -27.39 66.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.762 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -86.67 60.34 6.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.824 0.821 . . . . 0.0 110.639 175.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -137.25 116.78 12.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.059 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -63.1 117.98 7.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.071 0.462 . . . . 0.0 111.632 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -144.39 -176.39 5.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.89 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.3 m -78.51 171.82 14.56 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.622 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -152.45 135.66 15.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -167.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.587 HG13 ' HB3' ' A' ' 60' ' ' TYR . 67.6 mt -105.85 127.45 60.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 172.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.74 121.95 45.75 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -112.28 129.2 56.36 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.897 -175.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.73 ' HB ' ' HB3' ' A' ' 36' ' ' ALA . 10.2 tt -129.87 141.13 40.78 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -70.9 166.8 27.84 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.087 1.858 . . . . 0.0 110.57 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.38 57.74 1.57 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.964 176.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -106.07 17.52 23.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.078 0.466 . . . . 0.0 110.98 -173.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 m -61.05 -20.08 62.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.148 0.499 . . . . 0.0 111.228 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.468 HD13 ' N ' ' A' ' 133' ' ' LEU . 5.0 mp -79.84 -26.94 40.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.668 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -88.04 -37.54 16.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.221 0.534 . . . . 0.0 109.91 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.14 40.56 0.99 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.738 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.58 -57.36 11.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.986 -174.421 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.505 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 9.3 m-80 -74.26 -24.03 59.22 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.75 0.309 . . . . 0.0 110.625 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.97 -51.68 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -70.74 -23.52 62.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.394 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -70.88 -31.72 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.547 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -89.03 -6.37 57.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.456 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.833 -177.314 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HB2' HG23 ' A' ' 132' ' ' THR . 72.8 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.981 0.419 . . . . 0.0 112.052 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.88 169.17 19.69 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.829 2.352 . . . . 0.0 110.915 171.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.5 pt -72.27 -18.51 19.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.92 -49.49 70.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.985 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 25.2 m95 -62.05 139.24 58.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.889 178.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.474 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 14.1 mmm180 -84.71 129.51 34.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 111.315 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.37 121.46 42.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.933 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.449 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.4 t80 -121.41 105.16 10.25 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 69.55 -61.98 0.43 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.009 0.818 . . . . 0.0 110.956 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.8 m -152.31 -25.83 0.17 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.795 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -82.9 156.46 23.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -175.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.606 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 23.5 m -120.05 137.71 53.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.134 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.449 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 16.7 m-85 -131.8 135.15 46.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.651 0.262 . . . . 0.0 110.72 -175.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 41.5 t80 -134.17 117.16 13.5 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.128 175.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -84.65 129.31 4.15 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.727 2.285 . . . . 0.0 112.258 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.699 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -104.75 139.35 39.68 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.835 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.5 p -105.53 3.31 29.26 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.214 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -88.08 137.2 32.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.639 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 94.5 m-20 -74.51 122.97 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.279 0.561 . . . . 0.0 111.587 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.565 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 43.7 mmtm -141.19 151.31 43.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.01 175.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 63.5 p -73.07 170.44 14.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 172.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.634 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 20.8 t90 -62.6 -35.93 81.11 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.285 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.583 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -62.76 -51.62 66.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.55 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.565 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 11.0 mm-40 -61.53 -34.65 75.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.777 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.534 ' HB3' HD13 ' A' ' 38' ' ' LEU . 56.4 m -64.9 -45.07 87.46 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.367 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 17.2 pt-20 -73.74 -24.92 59.96 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.07 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.5 mtm180 -78.63 -49.67 12.82 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.874 0.369 . . . . 0.0 111.166 177.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.32 -31.53 71.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 32' ' ' SER . 1.3 t -84.52 177.94 7.9 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 172.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 20.6 m 76.88 -46.54 0.51 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 122.506 0.322 . . . . 0.0 110.675 -176.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.63 -33.15 75.95 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 121.221 -0.514 . . . . 0.0 111.937 174.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -79.57 2.07 23.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.849 0.356 . . . . 0.0 110.745 176.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.13 47.85 17.03 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.657 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -148.54 -177.41 5.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -150.64 169.52 21.38 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 173.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.658 ' HB2' HG23 ' A' ' 76' ' ' VAL . 4.1 mm? -57.18 138.8 54.16 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 171.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.908 ' HE2' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -48.88 108.64 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.844 0.715 . . . . 0.0 112.325 -173.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -93.33 88.97 6.18 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.723 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.908 HG12 ' HE2' ' A' ' 39' ' ' MET . 48.2 mt -57.17 111.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.083 -176.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.1 m -93.0 -32.7 14.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.78 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.477 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 2.9 t -138.75 153.85 48.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.0 112.128 -177.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.457 ' HG3' ' NH1' ' A' ' 85' ' ' ARG . 23.0 mt-10 -61.5 -35.26 77.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.79 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.426 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -63.58 -34.94 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.224 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.489 ' CD ' ' HZ3' ' A' ' 127' ' ' LYS . 57.8 tt0 -61.0 -51.41 69.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.316 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.455 ' HA ' HG23 ' A' ' 50' ' ' ILE . 50.6 tt0 -62.51 -40.35 96.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.064 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.99 -27.86 69.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 20.8 m-85 -88.3 -34.28 17.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.599 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -69.05 -33.39 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.861 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.5 pt -71.29 -4.45 4.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.86 0.362 . . . . 0.0 111.141 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.93 -27.46 26.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.717 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -89.91 -27.03 20.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.385 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.3 mt -74.89 129.45 37.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.168 -176.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.17 125.85 24.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.753 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.414 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.0 mtp180 -75.15 59.23 0.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.578 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.52 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -161.9 -30.93 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.724 177.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.52 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -84.26 172.62 11.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.0 -178.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 m -122.38 122.73 39.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.26 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.582 ' HB3' HG13 ' A' ' 125' ' ' ILE . 70.6 m-85 -110.37 122.04 46.74 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -170.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.575 ' HA ' HG13 ' A' ' 103' ' ' VAL . 39.6 m-85 -60.49 130.54 47.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.964 0.411 . . . . 0.0 111.361 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 104' ' ' LEU . 95.7 mt -99.95 174.37 6.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.197 178.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.75 47.95 3.9 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.322 -177.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.32 126.97 49.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.705 0.253 . . . . 0.0 110.359 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.634 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 8.1 ttm180 -124.61 124.12 41.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 176.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 39.1 t0 -116.96 153.72 32.13 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 163.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.708 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 27.9 tt0 -146.87 108.58 4.34 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.278 -168.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.594 HD21 ' HG2' ' A' ' 67' ' ' GLU . 48.8 m-80 68.53 23.83 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.744 0.653 . . . . 0.0 110.674 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.464 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 62.27 84.74 0.13 Allowed 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.985 0.803 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.708 ' HZ3' ' HB3' ' A' ' 67' ' ' GLU . 64.7 mttp -100.02 157.25 16.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.331 177.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -84.71 -12.34 75.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.094 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -123.8 102.34 7.75 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.338 0.589 . . . . 0.0 110.415 178.241 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 11.7 m0 -78.51 167.91 20.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.272 178.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.598 ' NH2' ' HA ' ' A' ' 78' ' ' GLN . 43.8 ttt-85 -144.11 143.6 31.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.277 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.474 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 67.7 m95 -78.75 167.17 21.59 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.658 HG23 ' HB2' ' A' ' 38' ' ' LEU . 69.4 t -60.06 -50.44 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.782 0.325 . . . . 0.0 110.999 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -96.94 77.79 2.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.964 0.411 . . . . 0.0 111.383 -174.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.598 ' HA ' ' NH2' ' A' ' 74' ' ' ARG . 44.5 tp60 69.36 -48.59 0.6 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 169.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 m -48.69 126.74 13.48 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 122.861 0.464 . . . . 0.0 112.083 -173.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -76.6 166.33 27.42 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.979 2.453 . . . . 0.0 111.776 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.556 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 84.1 t80 -53.82 132.79 42.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.14 0.495 . . . . 0.0 110.998 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -112.73 112.78 50.63 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.498 -175.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -67.43 -16.17 47.05 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.181 2.587 . . . . 0.0 112.929 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -100.48 -20.42 15.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.432 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.457 ' NH1' ' HG3' ' A' ' 44' ' ' GLU . 8.6 tpp180 -114.28 70.49 0.73 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.53 0.681 . . . . 0.0 110.11 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.1 p -151.27 142.07 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.754 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -118.3 -37.88 3.27 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.882 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.437 ' O ' ' HB1' ' A' ' 112' ' ' ALA . 99.3 m95 59.11 -165.02 0.2 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.139 -174.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.524 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 12.0 t-80 . . . . . 0 C--O 1.237 0.424 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.031 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 122.002 0.906 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 97.5 m -110.28 121.99 46.6 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.878 177.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 35.3 m -74.4 136.49 25.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.311 0.577 . . . . 0.0 111.442 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.575 HG13 ' HA ' ' A' ' 61' ' ' PHE . 32.8 m -116.89 154.93 18.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.609 176.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.485 ' HB2' HD23 ' A' ' 62' ' ' LEU . 13.8 tp -83.59 100.86 11.08 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -120.18 143.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.433 0.635 . . . . 0.0 111.784 -171.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 56' ' ' ARG . 65.5 t80 -83.61 97.03 8.85 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.76 176.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.524 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -143.83 131.48 21.25 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 85.6 mt-30 66.62 29.34 8.9 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 123.824 0.703 . . . . 0.0 109.302 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 t70 72.82 -14.61 0.57 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.625 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -108.23 138.73 44.02 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.394 0.616 . . . . 0.0 111.245 -176.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.414 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 92.8 m95 -74.68 131.83 41.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.14 176.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.474 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -160.78 167.36 26.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.765 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.431 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 14.7 m0 -80.2 121.46 25.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.785 -177.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -123.83 130.89 53.34 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.531 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.09 125.02 25.77 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.8 m -137.2 159.49 69.51 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.201 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.6 134.99 47.95 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.054 1.836 . . . . 0.0 110.577 172.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.0 m -69.17 -35.43 76.29 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.805 0.336 . . . . 0.0 110.364 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.517 ' HA ' ' HB ' ' A' ' 23' ' ' THR . 5.6 t30 -85.49 72.55 10.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.594 0.712 . . . . 0.0 109.412 170.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 23' ' ' THR . 84.9 t80 -137.85 131.59 31.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.95 -1.023 . . . . 0.0 108.798 176.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 26.0 mp0 -75.28 110.15 9.38 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.979 0.419 . . . . 0.0 110.878 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.492 ' HB1' ' CE2' ' A' ' 61' ' ' PHE . . . -146.76 -177.25 5.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.199 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 16.1 m -79.37 173.98 12.03 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.699 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 13.4 ptt180 -154.65 158.84 40.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.818 0.342 . . . . 0.0 111.686 -171.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.582 HG13 ' HB3' ' A' ' 60' ' ' TYR . 49.3 mt -127.17 126.6 68.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.874 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 17.9 m -103.09 131.57 49.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 174.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.489 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 86.6 tttt -119.2 131.31 55.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.032 -176.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.606 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 81.1 mt -107.81 134.23 20.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.126 173.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -67.01 166.33 23.26 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.215 1.943 . . . . 0.0 111.344 177.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.09 54.61 1.44 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.132 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 8.9 t -99.14 -19.06 17.37 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.816 -0.226 . . . . 0.0 110.897 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.465 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 4.4 t -65.93 -37.08 85.12 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.432 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 91.0 mt -58.83 -33.61 70.6 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.069 0.461 . . . . 0.0 111.27 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -81.61 -31.25 32.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.306 0.574 . . . . 0.0 109.678 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.51 7.8 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.052 -177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 132' ' ' THR . 50.6 mm-40 -62.88 -38.1 89.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.422 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 8.7 t30 -69.44 -32.95 72.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.975 176.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.28 -43.84 85.23 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -71.83 -20.75 61.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -68.93 -30.73 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.409 0.623 . . . . 0.0 109.635 173.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 14.3 mt-30 -86.53 -41.26 14.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.985 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.665 -177.88 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 m . . . . . 0 CA--C 1.519 -0.244 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -57.25 146.89 79.79 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.01 1.806 . . . . 0.0 110.994 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.86 -27.8 28.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.195 0.521 . . . . 0.0 110.753 -174.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -71.61 -34.88 70.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.079 176.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -69.88 141.86 53.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.672 ' HD3' ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -91.41 112.16 23.95 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.715 -174.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.79 133.53 35.12 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.022 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.453 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 79.1 t80 -138.68 102.57 4.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.977 178.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 63.74 -81.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.966 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.0 m -135.88 12.77 3.39 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.922 0.391 . . . . 0.0 110.986 -176.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -128.02 158.14 38.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.238 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 75.4 m -136.32 127.76 28.52 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 0.0 110.093 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 13.2 m-85 -118.54 138.49 52.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.383 -173.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -118.63 112.81 36.79 Favored Pre-proline 0 C--N 1.318 -0.789 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.884 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -89.8 121.56 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.197 2.598 . . . . 0.0 112.336 178.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.774 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.1 mm? -107.74 138.89 43.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.085 0.469 . . . . 0.0 110.884 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 p -90.87 -5.41 55.58 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.886 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.03 130.35 46.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.201 -1.363 . . . . 0.0 111.201 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -80.49 112.02 17.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.214 -175.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.622 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 39.2 mmtm -143.49 151.15 39.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.866 178.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 43.1 p -74.74 172.21 12.55 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 70.0 t90 -57.04 -41.53 78.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.091 0.472 . . . . 0.0 110.607 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -67.29 -45.19 77.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.397 -178.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.622 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 42.8 mt-10 -64.48 -36.63 84.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.46 -177.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.587 ' HG ' HD11 ' A' ' 38' ' ' LEU . 31.7 t -56.69 -44.71 81.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.761 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -79.53 -21.52 45.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.584 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 96.7 mtt180 -69.65 -40.15 76.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.895 0.379 . . . . 0.0 110.766 176.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -78.21 -31.23 49.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.346 0.593 . . . . 0.0 110.151 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 32' ' ' SER . 89.0 m -86.89 179.52 6.71 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.324 174.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 70.1 m 74.02 -40.15 0.45 Allowed 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.493 0.717 . . . . 0.0 110.472 -172.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.94 73.6 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 170.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.9 mtm -92.88 7.04 45.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.825 0.345 . . . . 0.0 110.542 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.05 -14.64 48.22 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.664 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 31' ' ' CYS . . . -95.32 141.69 28.6 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.775 -0.25 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.56 ' CD2' HG11 ' A' ' 76' ' ' VAL . 19.9 t60 -118.31 150.52 39.35 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.587 HD11 ' HG ' ' A' ' 27' ' ' SER . 3.3 mp -44.77 131.61 6.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.909 0.385 . . . . 0.0 111.929 -175.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.781 ' HE2' HG12 ' A' ' 41' ' ' ILE . 27.8 ttt -54.0 117.75 3.46 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.736 -169.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.562 HG23 ' OD1' ' A' ' 77' ' ' ASP . 19.2 p -104.79 97.07 7.01 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.22 174.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.781 HG12 ' HE2' ' A' ' 39' ' ' MET . 58.2 mt -66.09 113.17 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.408 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 m -94.66 -35.43 12.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.659 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 1.8 t -131.31 151.52 51.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.667 0.746 . . . . 0.0 111.887 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -59.83 -35.96 75.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.961 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.464 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.84 -41.06 97.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.997 0.427 . . . . 0.0 110.206 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.476 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.4 tt0 -55.02 -50.75 68.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.984 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.434 ' O ' HG22 ' A' ' 51' ' ' ILE . 51.9 tt0 -65.57 -49.24 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 178.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -59.33 -28.07 66.49 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -175.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.464 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 23.8 m-85 -85.97 -42.79 13.71 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.655 178.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.3 tp -68.17 -30.51 48.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.203 -175.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.629 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.0 pt -73.41 -2.64 3.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.479 -177.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -87.62 -23.12 24.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.826 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.672 ' CE1' ' HD3' ' A' ' 8' ' ' ARG . 83.1 m-85 -95.78 -24.95 16.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.602 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -69.51 141.92 53.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.286 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.617 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 13.7 t70 -70.03 117.5 11.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.533 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 80.6 mtt180 -76.34 55.79 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.302 0.572 . . . . 0.0 111.405 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.617 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 4.2 ttp180 -154.16 -32.68 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.22 152.78 18.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.054 0.454 . . . . 0.0 111.196 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 p -102.0 122.8 44.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.657 173.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.56 ' HB3' HG13 ' A' ' 125' ' ' ILE . 82.7 m-85 -102.25 127.57 49.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.369 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.536 ' HA ' HG11 ' A' ' 103' ' ' VAL . 26.6 m-85 -65.35 139.32 58.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.928 0.394 . . . . 0.0 111.577 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.76 HD12 ' HG ' ' A' ' 104' ' ' LEU . 86.2 mt -111.69 172.81 6.67 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.324 176.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -77.51 -5.36 85.86 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.535 -177.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.513 HD11 ' HB3' ' A' ' 73' ' ' TRP . 28.6 tp -73.68 115.65 13.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.266 0.533 . . . . 0.0 110.113 -178.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HD3' ' HB3' ' A' ' 67' ' ' GLU . 21.4 ttm180 -113.04 144.05 43.26 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.394 -172.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.499 ' CG ' ' HZ1' ' A' ' 70' ' ' LYS . 11.3 t0 -129.69 127.07 39.76 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 153.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.514 ' HB3' ' HD3' ' A' ' 65' ' ' ARG . 1.0 OUTLIER -105.89 14.38 28.12 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -172.211 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.5 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -163.95 17.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.93 178.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.33 40.13 31.49 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.502 0.668 . . . . 0.0 109.844 -174.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.632 ' HE2' ' HB2' ' A' ' 72' ' ' GLN . 14.2 mtmm -71.53 -24.9 62.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.736 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.26 6.7 70.86 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -174.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.632 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . 74.0 mt-30 -117.66 90.22 3.29 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.473 -178.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.542 ' CH2' HG12 ' A' ' 102' ' ' VAL . 98.6 m95 -72.26 129.92 39.57 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.167 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 62.8 mtm180 -132.48 142.7 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.428 ' CE3' HG21 ' A' ' 40' ' ' THR . 98.2 m95 -74.16 169.91 16.6 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.886 0.374 . . . . 0.0 110.452 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.56 HG11 ' CD2' ' A' ' 37' ' ' HIS . 12.7 p -78.78 -3.4 5.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.175 0.512 . . . . 0.0 111.723 -170.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.562 ' OD1' HG23 ' A' ' 40' ' ' THR . 3.4 p-10 -98.89 -80.79 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 175.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.506 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 0.9 OUTLIER -160.14 -23.77 0.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.006 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.427 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.6 m -54.53 130.49 63.17 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.805 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 2.9 Cg_exo -77.15 165.78 27.5 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.903 2.402 . . . . 0.0 111.536 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.58 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 91.4 t80 -58.27 132.33 53.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.003 0.43 . . . . 0.0 110.692 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.559 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 0.8 OUTLIER -85.5 122.85 73.38 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.059 -176.862 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -60.99 -18.42 57.5 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.853 2.369 . . . . 0.0 113.359 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtt180 -113.34 16.96 18.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 111.35 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.559 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 19.8 mmt180 -120.57 80.24 1.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 171.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.5 t -126.81 105.04 13.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.032 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.45 96.14 4.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.875 -177.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -121.21 -173.63 2.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.934 0.397 . . . . 0.0 110.625 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.436 ' CE1' ' HB1' ' A' ' 112' ' ' ALA . 95.4 m-70 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.9 t30 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.46 152.98 46.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.236 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 27.5 m -98.36 140.62 17.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.236 0.541 . . . . 0.0 111.209 179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.536 HG11 ' HA ' ' A' ' 61' ' ' PHE . 33.2 m -122.96 153.1 27.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 174.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.76 ' HG ' HD12 ' A' ' 62' ' ' LEU . 15.0 mt -82.89 110.58 18.01 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 173.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.7 p -123.56 136.98 58.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.683 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.452 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 58.0 t80 -82.06 96.15 7.67 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.353 176.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 108' ' ' GLN . 27.0 t-20 -143.89 135.33 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 52.4 mt-30 67.87 27.67 7.24 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -173.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 59.55 17.79 6.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.295 -1.321 . . . . 0.0 112.699 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -130.8 136.23 48.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.004 0.43 . . . . 0.0 110.251 175.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.629 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 80.0 m95 -76.65 104.45 7.16 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.683 175.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.436 ' HB1' ' CE1' ' A' ' 89' ' ' HIS . . . -137.83 160.99 37.78 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.215 -178.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.605 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 25.0 m0 -72.91 149.45 43.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -176.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.44 HD21 HG11 ' A' ' 116' ' ' VAL . 4.8 t30 -137.37 131.19 31.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.364 175.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.35 123.74 21.58 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 123.655 0.597 . . . . 0.0 110.547 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.44 HG11 HD21 ' A' ' 114' ' ' ASN . 18.6 m -146.52 151.66 43.77 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.586 177.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.69 135.53 62.45 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.201 1.934 . . . . 0.0 110.683 172.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 46.6 m -67.67 -20.6 65.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.916 0.389 . . . . 0.0 110.579 -176.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.438 ' C ' HD21 ' A' ' 119' ' ' ASN . 0.2 OUTLIER -91.43 66.72 5.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.464 0.65 . . . . 0.0 109.305 173.564 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -137.67 114.4 10.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.824 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.02 109.87 1.62 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.114 0.483 . . . . 0.0 110.826 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -143.54 -171.19 3.46 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.964 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 57.3 m -82.52 173.06 12.32 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.774 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -150.48 152.94 35.0 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -167.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.56 HG13 ' HB3' ' A' ' 60' ' ' TYR . 55.9 mt -136.97 131.41 46.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.96 177.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 90.2 m -120.24 143.89 48.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.184 0.516 . . . . 0.0 110.688 176.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -120.44 129.79 54.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.294 -0.867 . . . . 0.0 111.043 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.6 tt -124.22 144.89 46.83 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.93 156.49 43.69 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 121.7 1.6 . . . . 0.0 110.48 169.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.487 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -62.8 -11.09 35.03 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.003 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 58.5 p 62.96 -14.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.803 1.241 . . . . 0.0 113.501 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.646 ' HB ' ' HG2' ' A' ' 136' ' ' GLU . 23.1 p -79.16 -3.1 43.99 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.856 ' H ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -54.36 -33.64 59.51 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.303 172.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.618 ' H ' HD21 ' A' ' 133' ' ' LEU . 51.4 t-20 -90.89 -44.07 9.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.266 168.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.508 ' HB1' ' HA ' ' A' ' 132' ' ' THR . . . -86.24 0.83 52.86 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -164.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.646 ' HG2' ' HB ' ' A' ' 132' ' ' THR . 5.1 mm-40 -68.71 -44.63 73.49 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 44.2 t30 -71.48 -34.8 70.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.013 176.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.58 -46.45 89.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -66.01 -31.02 71.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.171 177.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.54 -42.54 67.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.212 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.5 mm-40 -78.05 -14.7 59.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.726 -175.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.346 -178.55 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.6 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.6 m . . . . . 0 C--O 1.234 0.279 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.6 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 81.7 Cg_exo -48.48 150.2 6.03 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 121.828 1.685 . . . . 0.0 111.655 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.07 -17.17 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -169.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -78.75 -33.0 46.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.069 0.461 . . . . 0.0 109.964 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 76.2 m95 -79.92 115.78 19.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.6 tpt180 -72.81 104.67 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.214 0.53 . . . . 0.0 110.358 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.2 133.27 42.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.198 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -134.73 102.24 5.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.411 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.73 -82.89 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.554 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.6 m -133.49 2.38 3.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.821 0.344 . . . . 0.0 111.389 -177.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -117.79 162.9 17.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.8 m -137.98 133.43 33.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.807 0.337 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -127.12 127.9 45.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.716 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.491 ' CD2' HD21 ' A' ' 18' ' ' LEU . 49.2 t80 -104.11 113.23 65.46 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 8.5 Cg_endo -89.96 119.41 0.81 Allowed 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 123.537 2.824 . . . . 0.0 111.597 174.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.491 HD21 ' CD2' ' A' ' 16' ' ' PHE . 1.1 pt? -135.31 140.57 45.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.448 0.642 . . . . 0.0 110.821 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.435 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 34.0 p -101.54 17.71 22.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.92 -172.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -73.23 141.37 47.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.528 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 18.5 m120 -67.8 118.7 11.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.571 -178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.858 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 2.3 mmpm? -159.89 146.91 16.38 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.582 0.753 . . . . 0.0 109.519 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.483 HG22 ' OE2' ' A' ' 121' ' ' GLU . 58.1 p -82.32 177.83 8.56 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.218 178.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.499 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 84.0 t90 -61.02 -45.68 93.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.91 82.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.595 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.858 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 21.9 mm-40 -63.6 -38.48 91.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.46 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.862 ' HG ' HD13 ' A' ' 38' ' ' LEU . 34.3 t -60.65 -48.66 80.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.803 0.335 . . . . 0.0 110.247 177.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -66.73 -27.02 67.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.67 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -82.83 -46.18 13.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.136 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -69.84 -35.52 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.521 0.677 . . . . 0.0 109.959 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 32' ' ' SER . 69.1 m -87.97 179.5 6.42 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.204 171.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.824 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 63.4 m 78.98 -43.39 0.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 122.905 0.482 . . . . 0.0 110.62 -174.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.82 -14.49 63.13 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.782 172.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.5 mtm -98.61 11.61 37.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.586 0.231 . . . . 0.0 110.9 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.12 -2.24 87.9 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.926 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.824 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -98.38 -173.88 2.68 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.683 0.393 . . . . 0.0 110.208 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -149.19 155.32 40.46 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.862 HD13 ' HG ' ' A' ' 27' ' ' SER . 23.1 tp -56.37 131.51 48.47 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.784 ' HE3' HG12 ' A' ' 41' ' ' ILE . 21.4 ttt -50.46 125.78 13.62 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -168.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.401 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 16.9 p -118.18 102.67 9.18 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.377 176.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.784 HG12 ' HE3' ' A' ' 39' ' ' MET . 58.2 mt -73.29 112.67 9.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.646 -177.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.9 t -102.91 -29.68 11.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.513 -177.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.425 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 71.0 p -123.3 151.39 42.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.555 0.693 . . . . 0.0 112.049 -175.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -63.1 -40.2 96.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.102 179.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.405 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.41 -38.58 90.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.589 177.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' A' ' 43' ' ' THR . 88.7 tt0 -54.85 -50.77 67.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.882 175.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.796 HE22 HD13 ' A' ' 104' ' ' LEU . 20.7 tp60 -59.16 -53.87 53.46 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 177.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.257 -175.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.578 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 47.5 m-85 -88.33 -18.66 27.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -175.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.1 tp -82.49 -31.97 10.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.272 -0.571 . . . . 0.0 111.153 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.1 pt -67.9 -9.39 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 30.2 pt20 -86.44 -21.67 26.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.842 0.353 . . . . 0.0 110.561 177.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -89.72 -30.04 18.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.055 0.455 . . . . 0.0 109.934 178.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 52.6 mt -68.84 147.27 51.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.002 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.455 ' HB3' HD22 ' A' ' 58' ' ' LEU . 14.7 t70 -85.09 131.77 34.41 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.7 mtt85 -78.03 14.47 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.314 -170.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 ttm-85 -105.86 -26.31 11.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.783 0.325 . . . . 0.0 110.726 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 55' ' ' ASP . 3.1 mm? -98.51 175.24 6.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.519 0.676 . . . . 0.0 112.119 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.4 m -128.96 122.97 31.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.105 -0.952 . . . . 0.0 108.828 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -108.21 122.88 47.84 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -172.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CD2' ' HB1' ' A' ' 122' ' ' ALA . 6.6 m-85 -67.38 140.49 57.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.779 HD11 ' HG ' ' A' ' 104' ' ' LEU . 93.4 mt -121.75 155.81 34.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.234 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.82 44.68 2.81 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.228 -0.51 . . . . 0.0 114.318 -172.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.474 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.7 tp -100.5 115.84 31.05 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -116.91 119.7 36.18 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -167.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.54 154.67 17.14 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 160.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.661 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.9 tt0 -137.74 86.63 2.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.026 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 71.94 36.3 1.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.319 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.34 67.21 0.74 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.672 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 53.0 mttp -94.78 -23.04 17.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.774 178.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.26 -19.93 12.0 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.133 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.418 ' HG2' ' HB3' ' A' ' 70' ' ' LYS . 3.7 pt20 -83.86 92.98 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.319 0.58 . . . . 0.0 110.588 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.611 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 89.9 m95 -65.47 104.99 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.063 177.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -123.18 133.62 54.22 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.509 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 97.0 m95 -73.44 151.47 41.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.42 -5.84 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -172.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.488 ' CG ' ' HG1' ' A' ' 79' ' ' THR . 39.3 p-10 -106.81 10.37 30.76 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 122.224 -0.297 . . . . 0.0 110.207 177.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 78' ' ' GLN . 5.2 tt0 81.04 6.36 1.33 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 124.275 0.984 . . . . 0.0 111.436 178.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.509 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 41.3 m -61.46 121.83 66.45 Favored Pre-proline 0 C--O 1.237 0.42 0 CA-C-O 121.008 0.432 . . . . 0.0 110.28 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -63.48 145.4 92.11 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 123.082 2.521 . . . . 0.0 112.544 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.611 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 71.9 t80 -61.52 134.26 56.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.108 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.54 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -95.23 106.71 27.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.275 175.296 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 27.3 Cg_exo -62.96 -24.86 74.04 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.631 2.22 . . . . 0.0 112.486 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -99.21 3.68 46.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.325 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.54 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 76.2 mtt180 -134.82 30.26 3.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.853 0.359 . . . . 0.0 111.32 -177.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.474 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 4.9 p -87.86 98.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.759 0.79 . . . . 0.0 109.552 174.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.38 74.14 10.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.481 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -64.23 156.35 29.04 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 173.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.633 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 24.7 t-80 . . . . . 0 C--N 1.324 -0.524 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.606 -173.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.766 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.4 p-10 . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.79 0.328 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 81.5 m -142.32 127.74 18.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.752 -173.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.647 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 16.8 m -78.9 146.67 7.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.014 0.435 . . . . 0.0 111.239 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 m -125.51 148.44 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.565 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.796 HD13 HE22 ' A' ' 47' ' ' GLN . 5.9 mt -83.88 106.13 15.32 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.4 p -128.54 139.61 51.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.847 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -83.42 97.35 8.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.771 174.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -137.75 139.46 40.11 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.688 -174.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 58.23 49.84 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.4 p30 53.05 18.91 1.23 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.551 1.14 . . . . 0.0 113.394 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.437 ' HB3' ' NZ ' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -145.69 144.93 30.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.477 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.408 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.0 m95 -79.22 127.74 32.43 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.74 172.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.633 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -167.94 173.86 7.86 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.269 0.356 . . . . 0.0 110.259 174.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.647 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.4 m0 -84.17 119.02 24.52 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.998 0.428 . . . . 0.0 111.135 -176.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -105.76 132.39 51.94 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 166.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.766 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 8.4 t70 -85.99 123.79 31.71 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.746 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 42.1 t -132.31 140.61 38.5 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -43.19 127.91 5.48 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.92 2.413 . . . . 0.0 111.668 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 5.8 m -69.65 -6.94 34.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.529 -172.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -96.61 9.64 40.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.425 ' O ' ' HA ' ' A' ' 23' ' ' THR . 80.9 t80 -86.31 132.21 34.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.038 176.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.483 ' OE2' HG22 ' A' ' 23' ' ' THR . 8.6 mm-40 -80.11 116.6 20.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.284 175.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.442 ' HB1' ' CD2' ' A' ' 61' ' ' PHE . . . -142.79 -168.97 2.9 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.531 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.435 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 27.0 m -82.66 171.43 14.03 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.414 ' CZ ' HD12 ' A' ' 18' ' ' LEU . 14.9 ptt180 -148.79 161.82 41.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.574 HG23 ' SD ' ' A' ' 39' ' ' MET . 4.4 mm -123.75 133.27 69.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.172 172.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 94.7 m -118.82 134.24 55.29 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.362 0.601 . . . . 0.0 110.328 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -112.18 135.95 52.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 -172.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.5 tt -139.06 142.45 33.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -64.52 166.96 16.09 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.306 2.004 . . . . 0.0 111.605 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.474 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -61.83 89.9 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.52 173.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.1 p -72.18 9.22 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 t -70.46 -15.32 62.8 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.82 -20.04 39.88 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.036 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -88.95 -46.99 8.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.228 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.8 26.11 2.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.886 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.435 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.19 -48.93 79.25 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -174.713 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.435 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 19.2 t-20 -73.93 -30.28 62.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 0.0 110.397 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.88 -45.11 90.87 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -74.63 -21.54 59.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.734 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -70.85 -34.67 71.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.056 0.455 . . . . 0.0 110.241 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -86.7 -6.25 58.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.747 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.211 -175.842 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.234 0.289 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.45 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 83.3 Cg_exo -48.37 143.98 14.24 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.063 2.509 . . . . 0.0 112.728 -177.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 27.9 pt -71.69 -11.56 15.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.34 -172.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.66 -18.95 39.24 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.572 ' HH2' ' HG3' ' A' ' 34' ' ' MET . 16.2 m0 -66.32 162.81 19.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.526 177.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.7 tpp180 -90.3 110.87 21.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.992 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.696 ' HB3' HD21 ' A' ' 133' ' ' LEU . . . -93.26 121.42 34.61 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.555 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 88.0 t80 -136.45 133.97 37.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.955 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.437 ' HG3' ' CE2' ' A' ' 10' ' ' PHE . 48.1 mt-30 57.48 -94.77 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.688 0.618 . . . . 0.0 110.77 -174.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.0 p -141.03 27.72 1.95 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -131.57 160.41 35.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.715 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HB2' HG21 ' A' ' 128' ' ' ILE . 7.8 m -117.59 127.36 53.89 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.555 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 22.4 m-85 -117.3 145.83 43.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.55 -174.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.499 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 5.8 t80 -136.41 115.2 10.68 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.305 176.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 4.8 Cg_endo -88.19 117.39 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.385 2.723 . . . . 0.0 111.828 177.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.583 ' HG ' ' NH2' ' A' ' 124' ' ' ARG . 3.5 mm? -95.23 142.13 28.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.422 -178.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 p -110.58 4.51 20.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -81.67 168.51 18.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.354 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.431 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 3.1 p-10 -104.37 129.54 52.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.751 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.578 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 14.4 mmmm -156.17 141.32 17.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.632 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 34.6 p -57.35 160.98 3.61 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 173.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.495 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 52.9 t90 -56.6 -44.13 80.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -55.23 -47.38 75.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.408 177.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.578 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 38.5 mm-40 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.698 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.434 ' OG ' ' HG2' ' A' ' 124' ' ' ARG . 49.5 m -59.25 -48.0 83.26 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.715 0.293 . . . . 0.0 110.66 173.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 36.0 tt0 -56.83 -44.16 81.79 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.797 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 78.0 mtt180 -75.54 -35.11 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.595 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -72.14 -28.72 63.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.442 -170.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 32' ' ' SER . 18.6 m -97.97 127.03 43.66 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 166.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.602 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 58.3 p 166.13 -60.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.303 0.377 . . . . 0.0 110.448 -174.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.08 -25.38 59.69 Favored Glycine 0 C--N 1.331 0.283 0 CA-C-N 115.384 -0.826 . . . . 0.0 113.36 -176.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.572 ' HG3' ' HH2' ' A' ' 7' ' ' TRP . 0.9 OUTLIER -86.56 15.46 5.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.8 0.333 . . . . 0.0 110.591 178.409 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.22 23.3 63.57 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.602 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -124.62 -179.09 4.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.361 0.6 . . . . 0.0 111.822 -172.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -137.16 169.12 18.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 30.4 tp -60.96 128.38 36.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 168.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.946 ' HE2' HD12 ' A' ' 41' ' ' ILE . 24.6 ttt -47.35 112.26 0.51 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -167.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 p -93.0 110.54 22.01 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.242 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.946 HD12 ' HE2' ' A' ' 39' ' ' MET . 16.5 mm -55.12 106.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 109.523 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -88.47 -38.37 15.06 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.627 -174.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.408 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 16.3 p -137.8 154.68 49.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.061 0.458 . . . . 0.0 110.866 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.93 -32.93 74.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.841 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -74.01 -34.69 64.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.729 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 43' ' ' THR . 37.0 tt0 -54.98 -50.16 69.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.109 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.691 HE21 HD22 ' A' ' 104' ' ' LEU . 40.4 tt0 -63.02 -47.32 83.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.736 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.841 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.8 p30 -68.43 -28.13 66.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.772 0.32 . . . . 0.0 111.356 -174.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -88.54 -17.78 29.52 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.504 HG21 ' HE1' ' A' ' 39' ' ' MET . 10.2 tp -87.45 -28.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 118.679 0.672 . . . . 0.0 111.09 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.688 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.7 pt -69.9 -11.16 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -87.29 -18.32 30.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.734 0.302 . . . . 0.0 110.672 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -91.65 -22.09 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 109.658 177.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 90.8 mt -74.91 145.33 42.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.458 178.211 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.612 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 12.2 t70 -74.72 117.4 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.485 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 43.2 mtt180 -68.98 57.95 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.471 0.482 . . . . 0.0 111.759 -178.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 2.9 ttp180 -158.2 -33.5 0.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.407 HD22 ' HB3' ' A' ' 55' ' ' ASP . 2.9 mm? -92.53 167.64 11.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.386 0.612 . . . . 0.0 111.672 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.589 ' HB3' HG23 ' A' ' 103' ' ' VAL . 1.4 m -112.88 118.87 36.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.847 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.471 ' O ' HG22 ' A' ' 103' ' ' VAL . 92.4 m-85 -107.84 121.03 43.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.235 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.511 ' CE2' ' HB1' ' A' ' 122' ' ' ALA . 26.7 m-85 -71.97 144.96 48.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.693 0.283 . . . . 0.0 111.149 177.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.641 ' CD2' ' HG ' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -133.2 176.59 8.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 174.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -79.74 62.51 4.14 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 115.067 0.787 . . . . 0.0 115.067 -167.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.641 HD22 HD11 ' A' ' 62' ' ' LEU . 3.5 mm? -115.12 104.61 12.03 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 166.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HB2' HG13 ' A' ' 76' ' ' VAL . 3.3 ttm-85 -93.82 116.91 29.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.197 0.522 . . . . 0.0 111.925 -169.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.666 ' HB3' ' HB2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -134.13 85.77 2.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.381 175.505 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.72 31.28 0.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.978 0.894 . . . . 0.0 108.817 176.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.857 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 3.6 t-20 179.05 137.17 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -168.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.51 87.51 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 120.946 0.403 . . . . 0.0 110.152 170.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.857 ' HZ3' ' HB3' ' A' ' 68' ' ' ASN . 2.2 ptpp? -126.33 118.91 26.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.821 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.01 54.03 2.19 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.969 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.557 ' HG2' ' HB2' ' A' ' 70' ' ' LYS . 9.8 pt20 -154.26 44.68 0.55 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.678 ' CH2' ' HB3' ' A' ' 100' ' ' ASN . 77.4 m95 -37.11 117.0 0.49 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.5 1.125 . . . . 0.0 112.449 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -117.39 156.89 27.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.068 0.461 . . . . 0.0 111.097 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.484 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 42.1 m95 -86.84 153.37 21.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.674 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.514 HG13 ' HB2' ' A' ' 65' ' ' ARG . 34.7 m -73.33 -6.94 8.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -173.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -129.54 81.75 2.04 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.369 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.475 HE21 ' N ' ' A' ' 79' ' ' THR . 0.0 OUTLIER 68.29 -56.45 0.5 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.273 1.029 . . . . 0.0 113.117 175.077 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.481 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 18.2 m -44.23 120.16 3.64 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 79' ' ' THR . 33.1 Cg_endo -66.91 169.64 14.42 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.361 2.708 . . . . 0.0 111.957 170.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -54.25 137.62 40.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.721 -177.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -91.09 108.23 26.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.08 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.84 -24.02 25.21 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 113.071 -176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -95.4 -27.39 15.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.778 0.323 . . . . 0.0 111.361 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -112.4 83.72 1.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.167 0.508 . . . . 0.0 111.487 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 t -124.22 100.92 8.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.14 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -98.28 92.34 5.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.677 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -96.09 173.79 7.24 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.505 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 79.8 m-70 . . . . . 0 C--N 1.327 -0.387 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.081 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.678 ' HB3' ' CH2' ' A' ' 73' ' ' TRP . 5.1 m-20 . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 116' ' ' VAL . 2.3 m 66.8 116.46 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 O-C-N 124.01 0.819 . . . . 0.0 111.6 168.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.621 HG12 ' CH2' ' A' ' 73' ' ' TRP . 4.7 m -107.16 144.98 15.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.645 0.736 . . . . 0.0 112.694 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.589 HG23 ' HB3' ' A' ' 59' ' ' SER . 2.2 p -111.43 148.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.394 175.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.691 HD22 HE21 ' A' ' 47' ' ' GLN . 12.0 mt -82.29 101.65 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 164.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.21 150.21 25.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 -175.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -81.35 115.16 20.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.061 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.505 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 40.2 t30 -162.1 129.85 3.99 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.455 ' C ' ' H ' ' A' ' 110' ' ' LYS . 18.3 mt-30 69.09 35.9 2.61 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -173.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.5 t70 71.31 -25.46 0.17 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.802 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.455 ' H ' ' C ' ' A' ' 108' ' ' GLN . 21.3 pttm -101.2 146.75 27.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.504 0.669 . . . . 0.0 111.15 -173.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.688 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 69.3 m95 -81.91 130.86 35.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.423 172.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -156.17 167.17 31.26 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.558 ' HA ' ' O ' ' A' ' 103' ' ' VAL . 42.0 m0 -71.74 143.59 49.56 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.667 0.605 . . . . 0.0 110.78 -176.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.466 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 3.9 t30 -140.52 147.47 39.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.39 174.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.92 124.64 23.56 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.387 0.429 . . . . 0.0 111.039 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.699 ' O ' ' HB2' ' A' ' 101' ' ' CYS . 3.5 m -154.89 116.46 2.42 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.694 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.17 147.59 8.1 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.8 2.333 . . . . 0.0 112.777 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.586 ' O ' ' HB ' ' A' ' 23' ' ' THR . 33.5 m -70.22 -11.52 60.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.65 0.262 . . . . 0.0 111.023 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -89.97 6.61 41.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.632 ' O ' ' HA ' ' A' ' 23' ' ' THR . 79.0 t80 -93.99 133.26 37.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.476 ' OE2' HG23 ' A' ' 23' ' ' THR . 7.8 mm-40 -83.67 134.24 34.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.047 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.511 ' HB1' ' CE2' ' A' ' 61' ' ' PHE . . . -159.47 -170.2 2.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.351 174.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 30.0 m -81.0 164.82 22.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.793 -177.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.583 ' NH2' ' HG ' ' A' ' 18' ' ' LEU . 42.1 mtm105 -127.86 161.72 28.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.137 0.494 . . . . 0.0 111.913 -170.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 19.5 mt -134.3 125.25 47.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 57.7 m -102.66 129.69 49.33 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.608 ' HB3' ' HA ' ' A' ' 39' ' ' MET . 1.1 tppp? -114.85 122.55 46.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.007 0.432 . . . . 0.0 110.838 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.609 HG21 ' HB2' ' A' ' 14' ' ' CYS . 8.3 tt -129.34 140.94 40.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.024 174.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.436 ' HD2' HG13 ' A' ' 128' ' ' ILE . 19.7 Cg_endo -59.16 153.26 53.79 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.265 1.976 . . . . 0.0 111.914 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -74.35 57.81 2.41 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.073 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.9 t -60.3 -35.32 75.31 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 122.736 0.415 . . . . 0.0 111.132 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.4 p -94.85 2.16 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.957 0.408 . . . . 0.0 111.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.696 HD21 ' HB3' ' A' ' 9' ' ' ALA . 10.5 mp -90.16 -31.38 17.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -87.29 -55.63 3.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.178 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 139' ' ' TYR . . . -90.14 40.06 0.99 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.436 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.417 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.61 -50.2 72.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -175.069 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.417 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 17.9 t-20 -80.1 -31.15 39.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.226 0.536 . . . . 0.0 110.285 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.24 -44.41 97.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.281 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 135' ' ' ALA . 0.2 OUTLIER -76.09 -25.09 55.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.989 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -67.47 -31.2 71.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -86.92 -5.43 59.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.123 -177.263 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.474 ' SG ' ' HA2' ' A' ' 130' ' ' GLY . 13.3 m . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 121.01 0.433 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.509 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 4.6 Cg_endo -86.51 163.02 9.53 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.554 2.836 . . . . 0.0 113.881 -176.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.1 mt 56.88 -98.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.572 171.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -118.93 15.46 13.38 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.523 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 79.0 m95 -68.63 105.09 2.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.537 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 30.3 mmt180 -73.35 114.46 11.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.896 -173.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.76 121.73 28.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.766 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.435 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 87.5 t80 -129.93 102.67 6.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.878 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 66.76 -70.7 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.568 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -142.35 -11.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.119 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -100.33 159.06 15.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.9 0.381 . . . . 0.0 111.487 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 73.4 m -133.69 127.95 33.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.668 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.462 ' OH ' ' HG3' ' A' ' 46' ' ' GLU . 13.2 m-85 -121.37 137.75 54.56 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.738 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.523 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 33.4 t80 -124.26 114.93 27.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.711 0.291 . . . . 0.0 110.357 176.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 19.2 Cg_endo -89.53 128.13 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 123.346 2.698 . . . . 0.0 112.429 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.557 HD22 ' NH2' ' A' ' 124' ' ' ARG . 4.1 mp -119.36 139.18 52.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.5 p -107.76 19.97 19.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -93.17 138.31 31.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.92 0.39 . . . . 0.0 110.867 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -56.38 115.56 2.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.719 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.707 ' HB2' ' HZ2' ' A' ' 22' ' ' LYS . 0.3 OUTLIER -156.11 141.1 17.27 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.904 0.383 . . . . 0.0 110.896 -174.142 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.42 ' OG1' ' HG3' ' A' ' 26' ' ' GLU . 77.7 p -81.65 158.46 24.29 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.475 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 54.6 t90 -57.17 -45.05 84.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.917 0.389 . . . . 0.0 110.634 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.17 91.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.177 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.543 ' HG2' ' NH1' ' A' ' 29' ' ' ARG . 47.3 mt-10 -72.46 -35.41 68.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.221 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.605 ' HB3' ' HD3' ' A' ' 124' ' ' ARG . 67.3 m -52.3 -51.28 59.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.03 175.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.405 ' CD ' ' HD1' ' A' ' 37' ' ' HIS . 9.8 tp10 -76.69 -21.08 55.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.605 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.543 ' NH1' ' HG2' ' A' ' 26' ' ' GLU . 53.1 ttp180 -68.4 -37.41 80.33 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.079 0.466 . . . . 0.0 110.762 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -81.15 -37.27 29.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.519 0.676 . . . . 0.0 110.035 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 32' ' ' SER . 86.6 m -85.47 179.91 7.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.631 175.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.675 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 27.6 t 79.62 -43.65 0.29 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 122.715 0.406 . . . . 0.0 110.643 -177.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.94 -20.07 64.11 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.325 175.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.3 mtm -92.15 9.22 34.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 0.0 110.343 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.13 51.03 7.11 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -172.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.675 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -144.56 -178.35 5.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.936 0.398 . . . . 0.0 111.446 -170.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.405 ' HD1' ' CD ' ' A' ' 28' ' ' GLU . 2.9 m-70 -159.46 166.84 30.1 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 169.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.92 158.4 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.589 174.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.409 ' HG2' ' HB ' ' A' ' 125' ' ' ILE . 65.3 mmm -46.51 104.19 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -174.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.467 HG22 ' CE3' ' A' ' 75' ' ' TRP . 18.9 p -98.72 93.28 6.0 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.498 0.665 . . . . 0.0 109.388 169.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.4 HG12 ' HE3' ' A' ' 39' ' ' MET . 64.5 mt -76.01 122.47 30.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.158 -173.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.0 m -107.86 -27.29 10.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.874 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.1 p -134.53 155.74 49.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.619 0.723 . . . . 0.0 112.241 -176.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -65.67 -37.96 87.96 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.623 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.695 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -69.33 -37.85 77.91 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.462 ' HG3' ' OH ' ' A' ' 15' ' ' TYR . 67.1 tt0 -53.72 -50.62 65.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.584 0.707 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.449 ' NE2' HD11 ' A' ' 51' ' ' ILE . 1.0 OUTLIER -64.14 -48.67 75.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.008 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.695 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.0 OUTLIER -68.12 -27.27 66.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.025 -175.529 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.596 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 3.2 m-85 -80.6 -32.48 36.41 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 178.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.552 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 8.9 tp -78.51 -30.47 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.509 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 40.9 pt -71.17 -9.69 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 11.1 pt20 -87.48 -13.44 43.14 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.382 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.63 -23.6 17.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.2 0.524 . . . . 0.0 109.639 174.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.9 mt -74.31 150.17 40.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.594 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.429 ' OD2' ' HD3' ' A' ' 57' ' ' ARG . 45.1 t0 -80.43 127.43 32.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.641 178.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.582 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 75.1 mtt180 -80.28 30.17 0.28 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -167.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.555 ' HG2' HD12 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -139.38 -1.2 1.72 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.779 169.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.555 HD12 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mp -100.74 157.7 16.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.13 0.49 . . . . 0.0 111.397 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.601 ' HB3' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -109.81 117.3 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.427 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.659 ' HB3' HG13 ' A' ' 125' ' ' ILE . 83.6 m-85 -108.77 121.46 45.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.522 0.201 . . . . 0.0 111.201 -176.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -64.99 141.82 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.186 0.517 . . . . 0.0 112.103 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.631 HD11 ' HG ' ' A' ' 104' ' ' LEU . 65.0 mt -107.06 158.73 16.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.152 175.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.58 49.98 4.15 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.217 -174.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.61 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 40.2 tp -131.59 124.07 29.24 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.8 ptm85 -133.99 154.37 51.16 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.748 0.785 . . . . 0.0 112.493 -174.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -112.17 152.52 28.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.216 -1.356 . . . . 0.0 107.359 166.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB3' ' HD2' ' A' ' 70' ' ' LYS . 4.2 tp10 -109.41 104.56 13.67 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.881 -172.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 11.2 m120 72.26 -66.74 0.29 Allowed 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.745 0.653 . . . . 0.0 110.798 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -179.82 80.26 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 123.75 0.82 . . . . 0.0 108.828 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.597 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 17.1 mtpp -101.51 -61.6 1.36 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.329 -174.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 115.53 -21.84 12.44 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.597 ' OE1' ' HB3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -113.96 107.23 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.687 0.756 . . . . 0.0 110.309 177.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.61 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 25.7 m95 -76.15 150.9 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.951 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 143.52 46.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 176.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.467 ' CE3' HG22 ' A' ' 40' ' ' THR . 98.7 m95 -74.98 161.72 29.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.7 p -75.96 -6.57 8.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.384 0.611 . . . . 0.0 111.396 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 15.4 p30 -109.0 21.24 17.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.284 175.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.448 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 57.8 tp60 79.29 -8.18 1.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.146 174.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 36.1 m -58.84 124.34 72.87 Favored Pre-proline 0 C--N 1.323 -0.569 0 O-C-N 122.06 -0.4 . . . . 0.0 110.525 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -62.54 149.57 90.58 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.534 2.156 . . . . 0.0 111.763 175.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.453 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 76.2 t80 -59.92 122.63 14.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.0 111.756 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.465 ' ND2' ' HB3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -82.19 106.76 7.0 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.49 174.349 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -63.7 -53.27 1.39 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.085 2.523 . . . . 0.0 112.484 -176.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -89.83 34.41 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.975 0.416 . . . . 0.0 111.305 -177.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.465 ' HB3' ' ND2' ' A' ' 82' ' ' ASN . 12.2 tpt180 -140.43 21.73 2.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.215 0.531 . . . . 0.0 109.623 176.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.527 HG22 ' CE3' ' A' ' 113' ' ' TRP . 11.0 p -107.04 148.8 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.11 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -129.0 74.74 1.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.25 -0.18 . . . . 0.0 110.692 -177.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.69 174.25 5.29 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.023 0.439 . . . . 0.0 111.102 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.64 ' CE1' ' HB2' ' A' ' 107' ' ' ASN . 54.5 m-70 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.688 0.28 . . . . 0.0 110.854 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.451 -0.387 0 CA-C-O 120.643 0.259 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 56.2 m -136.15 143.27 44.4 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.941 0.401 . . . . 0.0 109.981 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.525 HG12 ' HB2' ' A' ' 62' ' ' LEU . 12.1 p -95.04 145.06 8.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.256 0.55 . . . . 0.0 111.841 -171.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 59' ' ' SER . 1.0 OUTLIER -126.95 142.5 43.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.353 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.631 ' HG ' HD11 ' A' ' 62' ' ' LEU . 11.3 mt -83.64 109.44 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 167.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.43 148.28 31.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.609 -176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.582 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 10.2 t80 -87.75 96.09 10.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.095 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.64 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 14.2 m120 -131.48 144.04 50.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 65.89 24.73 11.23 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.62 0.575 . . . . 0.0 109.634 -176.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.64 22.94 12.73 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.833 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -137.08 148.3 46.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.025 0.44 . . . . 0.0 110.65 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.509 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 81.5 m95 -79.66 124.38 28.5 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.468 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -158.27 167.19 30.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.898 0.38 . . . . 0.0 111.096 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.527 ' CE3' HG22 ' A' ' 86' ' ' VAL . 7.6 m0 -78.55 138.75 38.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.969 -176.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -134.64 144.82 48.08 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -86.27 124.86 33.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.866 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.6 m -141.26 158.78 63.32 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.41 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.492 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 14.2 Cg_endo -58.1 133.17 53.72 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.406 2.071 . . . . 0.0 111.011 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 24' ' ' TRP . 3.8 t -72.52 -16.99 61.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.992 0.425 . . . . 0.0 111.245 -173.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -89.95 4.6 49.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.009 0.433 . . . . 0.0 110.185 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.492 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 63.3 t80 -81.2 151.01 28.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -102.93 142.34 34.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.23 0.538 . . . . 0.0 110.995 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.91 -167.62 1.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.26 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 26.4 m -78.91 170.99 15.82 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.141 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.605 ' HD3' ' HB3' ' A' ' 27' ' ' SER . 4.2 ttp180 -144.84 145.57 31.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -168.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.659 HG13 ' HB3' ' A' ' 60' ' ' TYR . 9.6 mt -128.4 125.29 63.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 89.8 m -113.04 146.58 38.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.037 0.446 . . . . 0.0 110.512 177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -121.12 132.92 55.15 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.304 -170.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.479 ' CG1' ' HB2' ' A' ' 36' ' ' ALA . 29.3 mt -128.59 141.06 40.27 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.979 176.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.566 ' HB2' HG22 ' A' ' 131' ' ' THR . 13.4 Cg_exo -65.87 133.59 34.29 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.325 1.35 . . . . 0.0 110.251 169.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.474 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -48.24 -55.93 9.84 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 121.224 -0.512 . . . . 0.0 112.105 -177.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' THR . . . . . 0.566 HG22 ' HB2' ' A' ' 129' ' ' PRO . 48.0 p 61.93 -31.76 0.08 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.078 1.351 . . . . 0.0 113.849 176.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 130' ' ' GLY . 10.3 t -63.12 -21.83 66.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.462 0.305 . . . . 0.0 111.045 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.527 ' H ' HD21 ' A' ' 133' ' ' LEU . 2.8 mm? -56.37 -21.23 23.44 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.627 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -87.39 -41.68 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.101 0.477 . . . . 0.0 110.195 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.79 16.95 8.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.271 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -55.49 -52.43 63.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.002 0.429 . . . . 0.0 111.246 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -73.77 -27.66 61.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.476 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -63.2 -47.99 80.22 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.637 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 53.2 t80 -75.12 -24.31 58.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.332 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -65.79 -26.56 67.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.347 0.594 . . . . 0.0 109.979 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -83.71 -32.79 25.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.423 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' SER . . . . . 0.637 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 96.7 p . . . . . 0 C--O 1.252 1.23 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.577 -170.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.451 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 76.2 m . . . . . 0 N--CA 1.455 -0.219 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.537 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 66.2 Cg_exo -53.07 154.15 14.24 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.356 2.037 . . . . 0.0 112.417 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.6 tp -70.47 -17.39 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.092 -171.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -83.16 -23.85 32.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.863 0.363 . . . . 0.0 110.841 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.537 ' HD1' ' HB2' ' A' ' 4' ' ' PRO . 37.2 m95 -82.1 154.86 25.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.027 0.442 . . . . 0.0 110.258 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 34.9 mmt-85 -108.61 118.13 35.97 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.119 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.46 133.05 35.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.974 -174.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.446 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.1 t80 -129.15 102.24 6.38 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 58.31 -97.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.777 -176.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.9 p -93.63 -38.43 11.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.92 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -82.56 168.45 17.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.537 -172.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 72.0 m -146.71 129.46 16.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.579 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.506 ' CE2' ' HE3' ' A' ' 127' ' ' LYS . 5.0 m-85 -120.93 141.91 50.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.578 0.228 . . . . 0.0 110.994 -173.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 47.4 t80 -128.69 118.23 19.85 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.018 176.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -84.69 120.16 2.34 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.672 2.248 . . . . 0.0 112.07 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.605 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.1 mp -109.08 139.83 43.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.996 0.427 . . . . 0.0 110.188 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.9 p -106.3 13.37 28.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.479 -177.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.531 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 12.4 p-10 -79.35 126.24 30.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.553 ' HB2' ' HB3' ' A' ' 121' ' ' GLU . 5.4 p-10 -70.59 104.45 2.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.73 0.776 . . . . 0.0 110.692 -177.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.454 ' HZ2' ' CD ' ' A' ' 26' ' ' GLU . 64.3 mmtt -135.71 156.71 48.4 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.217 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.0 p -77.67 171.55 14.77 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.371 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -60.07 -40.25 88.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.194 0.521 . . . . 0.0 109.996 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.7 -48.77 75.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.244 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.662 ' HG2' HH11 ' A' ' 29' ' ' ARG . 19.7 mt-10 -68.2 -34.97 77.25 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.283 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.414 ' HB3' HD12 ' A' ' 38' ' ' LEU . 67.9 m -53.17 -50.46 64.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.008 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.515 ' HG2' HD11 ' A' ' 38' ' ' LEU . 9.5 mm-40 -72.1 -22.23 61.38 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.724 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.662 HH11 ' HG2' ' A' ' 26' ' ' GLU . 51.1 mtp180 -69.03 -35.53 76.74 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.767 0.318 . . . . 0.0 111.273 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -80.51 -28.52 37.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.556 0.693 . . . . 0.0 109.747 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 93.4 m -85.42 178.61 7.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.473 173.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 t 74.96 -50.65 0.67 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.819 0.447 . . . . 0.0 110.954 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.15 -25.12 69.37 Favored Glycine 0 C--O 1.227 -0.293 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.151 178.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.3 mtm -91.89 6.08 47.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.579 0.228 . . . . 0.0 110.619 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.33 -1.18 87.98 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.64 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.558 ' HB1' ' HB ' ' A' ' 128' ' ' ILE . . . -96.82 -176.75 3.67 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.708 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.17 163.1 40.01 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 176.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.515 HD11 ' HG2' ' A' ' 28' ' ' GLU . 5.2 mp -56.16 144.66 28.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.04 0.448 . . . . 0.0 111.528 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.626 ' HE2' HG12 ' A' ' 41' ' ' ILE . 14.2 tpt -53.43 113.37 1.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.656 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 38.6 p -104.62 135.95 45.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.059 171.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.626 HG12 ' HE2' ' A' ' 39' ' ' MET . 36.8 mt -105.61 116.79 50.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.159 0.504 . . . . 0.0 110.716 -178.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -97.63 -40.58 8.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.233 -178.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.6 p -135.02 167.23 21.32 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.2 0.524 . . . . 0.0 111.378 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -70.66 -34.71 72.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.845 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.437 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -64.08 -46.62 83.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.384 178.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -54.98 -47.77 74.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.092 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.423 ' O ' HG22 ' A' ' 51' ' ' ILE . 35.0 tt0 -59.79 -56.37 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.044 176.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.426 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 12.6 m-80 -53.82 -42.19 68.15 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.197 -176.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.437 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 22.6 m-85 -67.19 -44.9 78.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.2 tp -75.52 -32.14 24.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.828 -174.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.566 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.1 pt -70.45 -7.09 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 110.981 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.1 mt-30 -87.13 -23.13 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.678 174.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -89.28 -21.49 23.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.093 0.473 . . . . 0.0 110.156 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 71.2 mt -78.05 145.03 36.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.126 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.8 t70 -77.65 127.85 33.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.552 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.1 mtt180 -75.86 24.67 0.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -171.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.8 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.9 ptp180 -124.38 -15.75 6.58 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.075 175.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.8 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.4 mm? -95.7 161.99 13.8 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.278 0.561 . . . . 0.0 111.624 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.5 m -118.29 117.08 28.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.225 175.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.706 ' HB3' HG13 ' A' ' 125' ' ' ILE . 87.0 m-85 -102.09 124.86 48.43 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -169.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.476 ' HA ' HG11 ' A' ' 103' ' ' VAL . 8.2 m-85 -58.85 135.73 57.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.843 0.354 . . . . 0.0 111.812 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 104' ' ' LEU . 68.0 mt -115.85 175.0 5.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.272 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.61 -15.91 80.96 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.918 -0.658 . . . . 0.0 114.176 -174.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.568 ' HB3' HG23 ' A' ' 102' ' ' VAL . 47.6 tp -71.08 120.26 16.4 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.956 0.878 . . . . 0.0 110.88 -172.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -116.79 137.82 51.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.956 -174.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 6.6 t70 -113.21 139.02 49.13 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 158.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.589 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 26.0 tt0 -114.34 92.38 3.94 Favored 'General case' 0 C--N 1.31 -1.118 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.435 -173.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.411 ' C ' HD21 ' A' ' 68' ' ' ASN . 0.2 OUTLIER 76.09 -63.79 0.38 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 124.311 1.007 . . . . 0.0 110.001 -176.145 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 179.3 77.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.424 1.078 . . . . 0.0 108.69 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 51.8 mttp -121.76 125.94 47.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.767 -176.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.54 54.55 3.68 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.301 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -154.4 66.14 0.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.363 0.602 . . . . 0.0 110.182 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.54 ' HB3' HD13 ' A' ' 64' ' ' LEU . 91.1 m95 -57.78 128.77 38.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.707 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.721 ' HD3' ' HA ' ' A' ' 78' ' ' GLN . 13.3 ttm180 -137.93 149.63 46.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.338 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.597 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 95.6 m95 -80.33 109.24 14.62 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 171.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 77' ' ' ASP . 2.8 p 28.25 -72.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 175.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.421 ' N ' ' O ' ' A' ' 75' ' ' TRP . 0.5 OUTLIER -78.85 -86.75 0.07 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 0.0 111.56 -173.41 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.721 ' HA ' ' HD3' ' A' ' 74' ' ' ARG . 21.6 tp60 -145.99 -1.72 0.75 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.1 0.476 . . . . 0.0 109.87 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.597 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 71.4 m -60.46 117.48 24.95 Favored Pre-proline 0 N--CA 1.452 -0.367 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.384 178.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 28.5 Cg_exo -63.85 147.11 92.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.177 2.585 . . . . 0.0 112.978 -176.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.39 147.01 52.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.472 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -83.6 124.7 75.07 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.304 -177.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.71 -2.66 12.9 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.651 2.234 . . . . 0.0 113.86 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.625 ' HA ' ' NE ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -130.39 -34.53 1.6 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.79 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -83.47 82.53 8.25 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.969 0.414 . . . . 0.0 110.016 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.87 111.0 28.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.762 -178.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -121.09 91.88 3.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.022 -175.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -99.68 -178.44 3.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 110.98 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.663 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 72.9 m-70 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.574 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.549 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 35.1 t30 . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 121.245 0.545 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 59.2 m -120.85 132.92 55.27 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.575 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 15.5 m -88.8 141.85 13.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.291 0.567 . . . . 0.0 111.035 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' A' ' 61' ' ' PHE . 27.8 m -115.67 152.65 17.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.82 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.428 ' HB2' HD12 ' A' ' 62' ' ' LEU . 16.7 tp -83.55 101.85 11.74 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 174.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p -118.68 142.51 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.283 0.563 . . . . 0.0 111.283 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.431 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 88.2 t80 -77.86 117.89 19.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.47 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.663 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 22.7 t-20 -151.48 116.38 5.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.467 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 110' ' ' LYS . 50.0 mt-30 66.03 46.65 2.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.402 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 74.31 -25.45 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.371 1.044 . . . . 0.0 112.231 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 108' ' ' GLN . 12.3 pttm -106.22 146.04 30.8 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.457 0.646 . . . . 0.0 111.45 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.566 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 61.5 m95 -91.73 136.36 33.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.193 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.452 ' HB1' ' CE1' ' A' ' 89' ' ' HIS . . . -156.04 171.33 20.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.575 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 6.9 m0 -77.84 138.7 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.302 0.377 . . . . 0.0 110.451 -175.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -130.37 129.88 43.67 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.47 124.4 23.47 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.572 0.545 . . . . 0.0 111.417 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.4 m -146.41 157.72 48.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.86 138.46 85.85 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.026 1.817 . . . . 0.0 111.467 174.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.5 m -62.76 -20.1 64.63 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.14 0.495 . . . . 0.0 110.356 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -98.12 80.65 2.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.729 0.776 . . . . 0.0 109.11 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -155.26 110.09 2.98 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.434 -1.257 . . . . 0.0 108.232 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 21' ' ' ASN . 5.6 mp0 -63.28 110.27 1.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.102 0.477 . . . . 0.0 111.224 -175.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -140.35 -174.03 3.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.553 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.6 p -83.15 171.61 13.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.605 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -147.92 147.98 30.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.909 0.385 . . . . 0.0 111.906 -170.623 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 60' ' ' TYR . 43.7 mt -117.43 131.76 69.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.3 t -117.54 133.8 55.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . 0.506 ' HE3' ' CE2' ' A' ' 15' ' ' TYR . 21.3 ptmt -123.2 139.91 53.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.973 0.416 . . . . 0.0 110.39 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.558 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 10.9 tt -131.42 140.44 38.45 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 163.76 36.81 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.668 1.578 . . . . 0.0 110.749 170.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.04 59.66 1.41 Allowed Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.967 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.2 t -96.52 14.76 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 23.3 m -57.7 -32.4 67.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.658 ' H ' HD13 ' A' ' 133' ' ' LEU . 2.9 mp -71.18 -43.36 67.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.162 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -67.2 -26.31 66.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.468 0.652 . . . . 0.0 110.244 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.28 25.22 1.96 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.317 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 9.2 pt-20 -54.5 -51.43 65.12 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.712 0.291 . . . . 0.0 111.401 -178.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.452 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 0.2 OUTLIER -74.13 -32.25 63.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -178.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.37 -46.77 88.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -69.42 -29.31 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.509 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -67.46 -23.8 65.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.706 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 27.7 mt-30 -86.72 -5.57 59.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.642 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.909 -177.566 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 13.8 p . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' A' ' 3' ' ' CYS . 79.4 Cg_exo -48.89 139.88 24.5 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.542 2.161 . . . . 0.0 112.313 176.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tt -72.37 89.19 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 121.946 0.879 . . . . 0.0 110.741 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -172.81 -52.48 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.283 -1.326 . . . . 0.0 108.101 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -75.19 128.42 35.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.098 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -74.33 104.22 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.15 0.5 . . . . 0.0 110.686 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.469 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . . . -70.55 134.44 47.67 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.959 177.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.406 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 74.9 t80 -144.49 124.7 13.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.573 178.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 64.0 -82.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.353 0.661 . . . . 0.0 111.392 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.0 m -146.19 6.99 1.02 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -120.77 166.67 13.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 69.9 m -122.61 126.93 48.69 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 32.6 m-85 -120.15 117.05 26.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.456 -174.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -111.66 115.64 51.15 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 0.0 110.703 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -85.79 122.41 2.29 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.294 2.662 . . . . 0.0 112.203 177.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.91 138.4 41.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.752 0.31 . . . . 0.0 110.342 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.4 p -89.03 -4.28 58.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.32 0.581 . . . . 0.0 109.907 174.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.434 ' CG ' ' HZ2' ' A' ' 22' ' ' LYS . 7.1 t70 -66.2 139.97 58.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.919 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -97.28 123.69 41.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.58 -174.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.434 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 5.9 mttp -155.54 158.81 39.06 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.958 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.616 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 72.6 p -70.74 167.16 19.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 174.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.713 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.6 t90 -61.07 -35.19 76.3 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.001 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.469 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -63.62 -52.23 61.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.71 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.1 -40.5 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.524 ' HB3' HD11 ' A' ' 38' ' ' LEU . 47.6 m -58.05 -40.38 80.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.288 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.433 ' HA ' HD21 ' A' ' 38' ' ' LEU . 43.9 tt0 -74.03 -26.22 60.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.12 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.4 mtm180 -79.03 -45.1 20.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.09 0.471 . . . . 0.0 110.961 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.1 -37.87 88.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.722 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.5 m -85.57 178.9 7.23 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 171.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.52 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 24.9 m 76.85 -47.19 0.52 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.903 0.481 . . . . 0.0 111.138 -178.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.53 -20.19 67.61 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.109 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.4 mtm -93.15 6.73 46.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.699 0.285 . . . . 0.0 110.573 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.1 -5.93 69.48 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.725 -175.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.52 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -96.42 179.43 5.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.458 -0.371 . . . . 0.0 110.701 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.573 ' HB3' HG13 ' A' ' 76' ' ' VAL . 97.3 m-70 -147.45 169.57 19.24 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 27' ' ' SER . 3.9 mm? -59.05 154.72 15.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.865 0.302 . . . . 0.0 111.283 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.935 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.7 tpt -49.77 108.47 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.458 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.583 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 70.3 p -108.15 108.04 18.93 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.283 0.563 . . . . 0.0 110.246 177.067 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.528 HG12 ' HE2' ' A' ' 39' ' ' MET . 60.9 mt -73.42 103.09 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.453 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.4 m -77.99 -48.7 15.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.06 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 55.5 p -125.42 170.15 11.67 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.85 0.833 . . . . 0.0 111.871 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -61.82 -25.84 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.55 -41.68 72.15 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.285 177.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' A' ' 43' ' ' THR . 1.9 mp0 -48.25 -54.88 12.06 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.209 0.528 . . . . 0.0 109.588 171.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.769 HE22 HD11 ' A' ' 51' ' ' ILE . 0.8 OUTLIER -55.31 -59.97 4.06 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.623 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -58.55 -40.51 83.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -173.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -84.44 -36.39 22.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.602 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.25 -33.36 57.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.824 -176.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.769 HD11 HE22 ' A' ' 47' ' ' GLN . 43.0 pt -69.99 -10.33 13.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -76.01 -33.99 59.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.926 0.394 . . . . 0.0 110.0 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.89 -25.65 24.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.552 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 80.6 mt -67.94 140.2 56.43 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.662 -178.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.516 ' HB3' HD21 ' A' ' 58' ' ' LEU . 11.3 t70 -77.4 128.84 34.95 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.58 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 82.5 mtt180 -81.04 7.42 10.88 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -167.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.892 ' HG2' HD23 ' A' ' 58' ' ' LEU . 5.0 ptp180 -103.8 -13.5 16.4 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.01 176.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.892 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -101.52 150.29 23.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.059 0.457 . . . . 0.0 110.912 179.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.1 m -107.15 124.52 49.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.616 ' HB3' HG13 ' A' ' 125' ' ' ILE . 88.6 m-85 -105.89 122.38 46.0 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -172.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.75 ' HA ' HG12 ' A' ' 103' ' ' VAL . 21.5 m-85 -59.92 140.63 56.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.633 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.565 HD21 ' HG ' ' A' ' 104' ' ' LEU . 82.4 mt -107.68 168.22 9.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.397 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -92.84 25.48 19.15 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.148 -177.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.659 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 38.7 tp -92.87 109.03 20.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.429 ' HE ' ' HH2' ' A' ' 24' ' ' TRP . 13.2 ttm180 -96.34 122.07 38.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -173.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -104.59 154.26 20.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 157.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 68' ' ' ASN . 27.8 tt0 -135.24 95.82 3.37 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.284 -174.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 18.5 m120 78.7 -45.29 0.38 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.188 175.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 68' ' ' ASN . . . 165.14 -6.34 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.981 -171.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 35.1 mttp -68.09 94.03 0.47 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 172.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -69.0 72.56 0.39 Allowed Glycine 0 C--N 1.329 0.162 0 O-C-N 123.649 0.593 . . . . 0.0 113.266 -176.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -125.22 74.45 1.38 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.659 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 92.1 m95 -68.19 104.88 1.93 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.303 -175.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -134.15 152.34 51.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.164 177.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.583 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 85.5 m95 -85.88 147.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 120.256 -0.578 . . . . 0.0 109.599 177.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.573 HG13 ' HB3' ' A' ' 37' ' ' HIS . 11.3 p -77.53 -6.76 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -167.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.557 ' CG ' ' HG1' ' A' ' 40' ' ' THR . 22.9 p-10 -100.69 -60.05 1.59 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 121.334 -0.854 . . . . 0.0 111.214 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.24 -21.57 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.172 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.437 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.3 m -60.33 122.07 64.48 Favored Pre-proline 0 C--O 1.24 0.592 0 CA-C-O 121.569 0.699 . . . . 0.0 111.811 -172.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.9 Cg_exo -71.12 157.31 57.91 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.223 2.615 . . . . 0.0 111.312 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -71.89 126.14 28.98 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.466 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.496 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 19.7 m-80 -96.24 106.38 28.42 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.417 179.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.03 -29.45 40.31 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.517 2.144 . . . . 0.0 112.211 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -78.98 -22.89 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.736 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 73.0 mtt180 -117.97 31.34 6.75 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.246 -171.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 86' ' ' VAL . 7.1 p -88.78 91.6 3.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 122.116 0.96 . . . . 0.0 109.661 175.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.01 68.12 9.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.366 -169.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.428 ' CD1' HG22 ' A' ' 86' ' ' VAL . 79.0 m95 -74.23 143.8 44.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 172.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.567 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 83.6 m-70 . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 171.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.8 t30 . . . . . 0 N--CA 1.471 0.596 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -154.83 160.7 41.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 173.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.433 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.3 m -107.65 148.02 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.17 0.509 . . . . 0.0 112.171 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.75 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -125.74 156.69 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.563 175.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.565 ' HG ' HD21 ' A' ' 62' ' ' LEU . 15.4 mt -86.53 118.39 25.92 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.3 p -134.81 143.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.601 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -80.56 105.72 12.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.42 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 48.1 t30 -156.81 140.03 15.57 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.155 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' A' ' 109' ' ' ASP . 41.9 mt-30 67.34 40.7 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.831 0.707 . . . . 0.0 109.688 -175.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' A' ' 108' ' ' GLN . 31.2 t70 78.82 -16.22 0.69 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.493 174.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.547 ' HZ1' ' HB2' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -135.75 170.79 15.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.477 0.656 . . . . 0.0 112.213 -174.299 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.58 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 72.2 m95 -88.07 130.63 34.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.539 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.567 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -153.04 171.1 18.91 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -78.01 131.88 37.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.554 0.534 . . . . 0.0 110.807 -173.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -121.17 127.95 52.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.087 174.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -82.8 125.69 31.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.254 0.549 . . . . 0.0 110.59 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.9 m -141.33 155.23 67.78 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.159 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.89 133.12 53.88 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.18 1.92 . . . . 0.0 111.246 172.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.713 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 66.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.181 -178.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -77.24 -7.77 56.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.427 . . . . 0.0 110.651 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -83.59 140.98 31.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -104.52 145.21 30.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.223 0.535 . . . . 0.0 111.33 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -159.8 -168.78 2.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.353 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.3 m -78.39 170.82 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.448 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 12.9 ptt180 -152.17 148.07 27.18 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.944 -171.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.935 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.3 mt -113.23 135.26 53.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.5 t -114.31 130.78 56.67 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -115.54 131.94 56.78 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.655 -175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.46 ' HB ' ' HB3' ' A' ' 36' ' ' ALA . 11.2 tt -127.54 138.5 32.96 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 175.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -64.48 166.32 17.79 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.048 1.832 . . . . 0.0 111.042 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -70.13 82.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.924 177.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 17.0 p -76.36 18.53 0.3 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 122.818 0.447 . . . . 0.0 111.797 -177.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.424 ' H ' ' C ' ' A' ' 130' ' ' GLY . 9.4 t -65.36 -14.41 60.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.106 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -69.69 -29.48 66.91 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.505 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . 0.404 HD21 ' C ' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -73.48 -38.9 65.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.97 28.2 1.64 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.967 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 7.8 pt-20 -52.31 -51.65 57.43 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.374 0.421 . . . . 0.0 112.005 -175.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.426 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 28.7 p-10 -80.5 -27.53 37.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.653 0.264 . . . . 0.0 110.895 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.2 -49.78 70.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -73.54 -22.32 60.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -67.69 -33.1 74.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.084 0.469 . . . . 0.0 110.061 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.6 mt-30 -88.14 -6.17 58.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.413 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.026 -175.339 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.8 m . . . . . 0 C--O 1.234 0.241 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.13 147.36 54.55 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.016 1.811 . . . . 0.0 111.258 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.14 -24.93 34.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 121.182 0.515 . . . . 0.0 110.966 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -59.7 -58.22 9.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.418 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -64.71 138.7 58.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.212 176.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.494 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 1.7 tpp180 -86.0 106.88 17.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.092 0.472 . . . . 0.0 110.743 -176.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.25 122.54 26.44 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.38 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.444 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 65.7 t80 -140.14 119.04 12.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 56.76 -129.6 1.78 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.111 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -88.4 -4.94 58.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.706 0.289 . . . . 0.0 111.138 -178.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -105.67 169.17 8.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.136 0.493 . . . . 0.0 111.524 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.5 m -139.6 135.54 33.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.149 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.444 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 17.4 m-85 -124.43 129.64 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.932 -172.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 40.3 t80 -116.46 114.16 40.48 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.398 175.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.2 Cg_endo -88.77 130.97 2.27 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.334 2.689 . . . . 0.0 112.4 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.545 ' O ' ' HB3' ' A' ' 123' ' ' SER . 5.8 mp -107.63 140.5 40.56 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.52 60.2 1.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.398 0.618 . . . . 0.0 112.121 -171.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.455 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 1.3 t70 82.44 -168.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.292 165.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 65.1 27.44 12.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.099 -178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -141.81 141.44 33.15 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.347 0.594 . . . . 0.0 110.962 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 p -91.94 166.2 12.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.058 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.658 ' CH2' ' HG3' ' A' ' 65' ' ' ARG . 58.7 t90 -64.91 -34.78 79.22 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.3 -177.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.58 -51.88 68.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.34 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.67 -43.49 93.97 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.185 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.508 ' HB3' HD12 ' A' ' 38' ' ' LEU . 69.0 m -55.01 -46.92 75.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.468 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -68.91 -26.05 64.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.942 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -83.66 -30.24 26.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.815 0.341 . . . . 0.0 110.989 178.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.59 -42.68 19.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.569 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.4 m -101.26 128.67 47.28 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 p 154.31 -65.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.668 1.23 . . . . 0.0 108.78 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.52 -19.37 72.75 Favored Glycine 0 C--O 1.227 -0.295 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.917 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.8 mtm -78.53 1.06 23.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.751 0.31 . . . . 0.0 110.564 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.82 -11.88 63.22 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.684 ' HB1' ' HB ' ' A' ' 128' ' ' ILE . . . -96.49 161.98 13.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.576 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.432 ' HB3' HG21 ' A' ' 76' ' ' VAL . 28.3 m-70 -130.25 170.41 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.508 HD12 ' HB3' ' A' ' 27' ' ' SER . 4.5 mm? -56.89 148.44 20.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 173.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.762 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -46.65 106.64 0.09 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.833 0.708 . . . . 0.0 112.57 -174.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.522 HG23 ' CE3' ' A' ' 75' ' ' TRP . 24.3 p -105.9 89.08 2.97 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.182 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.746 HG12 ' HE2' ' A' ' 39' ' ' MET . 30.1 mt -65.69 110.85 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 110.26 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.6 m -102.34 -30.8 10.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.941 -175.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 32.0 p -131.61 155.25 47.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.461 0.648 . . . . 0.0 112.309 -177.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -62.35 -46.78 87.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.988 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.5 -39.2 79.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.51 ' HB3' ' O ' ' A' ' 43' ' ' THR . 84.1 tt0 -52.46 -57.25 10.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.673 176.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -61.04 -50.91 71.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.928 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -57.22 -31.34 65.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -88.28 -36.53 16.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.588 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.1 tp -73.1 -30.25 31.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.836 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.586 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.2 pt -71.67 -4.53 4.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.063 0.459 . . . . 0.0 110.997 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -87.85 -27.26 22.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.932 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -87.91 -22.97 24.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.642 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 73.7 mt -70.54 149.93 46.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.86 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -57.73 -28.34 63.79 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.928 -177.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.639 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 60.0 mtt180 64.5 20.35 12.12 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.668 0.747 . . . . 0.0 109.273 -168.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.3 ttp180 -120.69 -21.7 6.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.076 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -117.85 169.99 9.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.7 p -107.43 122.1 45.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.257 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -104.67 120.51 41.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 -172.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.435 ' HZ ' ' O ' ' A' ' 120' ' ' PHE . 44.7 m-85 -55.19 136.97 48.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.021 0.439 . . . . 0.0 111.851 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.6 HD22 ' HB2' ' A' ' 104' ' ' LEU . 78.0 mt -108.21 -175.07 2.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.276 177.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.435 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -96.07 11.35 67.64 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.965 -174.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.541 ' HB3' HG22 ' A' ' 102' ' ' VAL . 28.7 tp -80.05 119.44 22.88 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.658 ' HG3' ' CH2' ' A' ' 24' ' ' TRP . 31.1 ttt-85 -111.81 126.25 54.88 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -133.75 149.95 51.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.428 -0.805 . . . . 0.0 108.945 164.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 2.4 pt-20 -148.46 119.96 7.95 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.007 0.432 . . . . 0.0 110.477 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 58.01 33.97 23.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.613 176.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 67.99 80.79 0.2 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.744 0.653 . . . . 0.0 112.023 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 58.0 mttp -129.03 113.03 14.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.663 175.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.5 59.74 1.2 Allowed Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.088 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -137.59 70.28 1.4 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -61.13 108.66 0.93 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.966 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 74' ' ' ARG . 55.1 mtm-85 -141.38 172.41 12.72 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.522 ' CE3' HG23 ' A' ' 40' ' ' THR . 97.4 m95 -86.11 173.29 9.95 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 174.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.432 HG21 ' HB3' ' A' ' 37' ' ' HIS . 19.6 m -78.33 39.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 111.265 179.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 11.3 t70 -164.74 -160.16 0.49 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.466 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 22.4 tp60 -78.67 -6.44 55.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.413 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 3.5 m -74.0 120.85 83.39 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.834 -177.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 3.4 Cg_exo -78.34 155.59 28.78 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.946 2.431 . . . . 0.0 111.651 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.86 133.15 51.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.935 0.397 . . . . 0.0 110.368 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.611 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -101.44 115.55 64.88 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.67 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.88 -9.59 25.34 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.695 2.263 . . . . 0.0 112.319 177.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 84' ' ' ARG . 6.1 tpp180 -110.1 1.52 18.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.161 0.505 . . . . 0.0 110.238 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.611 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 20.2 mmt180 -128.77 57.29 1.62 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.346 0.593 . . . . 0.0 110.048 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.2 p -138.25 139.67 41.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.609 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -127.51 76.4 1.67 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.716 0.293 . . . . 0.0 110.565 -177.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -67.97 -176.05 0.64 Allowed 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.655 0.741 . . . . 0.0 112.439 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.511 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 1.2 m-70 . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.478 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.1 m120 . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 121.019 0.438 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.7 m -119.87 123.25 43.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.045 0.45 . . . . 0.0 110.398 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.541 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.2 m -80.77 135.6 24.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.068 0.461 . . . . 0.0 110.526 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.7 m -115.39 147.57 18.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.826 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.6 ' HB2' HD22 ' A' ' 62' ' ' LEU . 28.0 tp -83.16 101.73 11.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 175.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.3 p -121.83 145.58 28.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 -174.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.427 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 29.7 t80 -86.08 99.41 11.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.538 177.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.511 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.3 t-20 -149.48 137.28 20.33 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.473 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 92.2 mt-30 69.83 24.71 5.21 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -171.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.2 t70 71.18 -11.3 0.69 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.098 -1.41 . . . . 0.0 111.637 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.417 ' H ' ' C ' ' A' ' 108' ' ' GLN . 14.5 ptmm? -109.04 150.67 27.45 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.0 110.304 -178.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.639 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 95.1 m95 -77.42 130.83 37.58 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -152.47 156.41 39.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.823 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.537 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 17.8 m0 -81.14 115.31 20.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.37 -178.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -107.03 133.88 51.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -77.89 124.09 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.257 0.348 . . . . 0.0 111.07 -179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.428 HG22 ' CE1' ' A' ' 120' ' ' PHE . 3.3 m -149.56 158.52 37.71 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.974 176.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -60.89 137.32 71.66 Favored 'Trans proline' 0 CA--C 1.531 0.338 0 C-N-CA 122.282 1.988 . . . . 0.0 111.787 175.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 41.8 m -64.67 -23.85 67.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.39 15.14 18.42 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.023 -0.423 . . . . 0.0 111.169 -174.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 122' ' ' ALA . 0.1 OUTLIER -84.55 140.42 31.43 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.91 128.45 35.54 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.788 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 120' ' ' PHE . . . -161.87 -169.24 2.16 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.242 0.544 . . . . 0.0 111.261 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.545 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 14.5 m -96.6 -176.58 3.65 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.615 177.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.44 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 13.9 ptt-85 -165.41 170.08 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.045 0.45 . . . . 0.0 111.35 177.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.762 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.0 mt -122.35 135.73 61.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 6.1 t -103.43 129.16 50.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -111.95 113.08 25.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.823 -171.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.684 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 11.5 tt -124.85 138.78 32.04 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-O 120.867 0.365 . . . . 0.0 110.883 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -70.08 167.54 24.58 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 123.15 2.567 . . . . 0.0 111.99 170.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.56 93.37 0.14 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.715 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.3 p -78.21 33.22 0.19 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 21.4 p -67.36 -17.13 64.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.996 0.427 . . . . 0.0 110.837 176.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 78.9 mt -73.38 -18.14 61.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.568 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -88.67 -56.52 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 110.071 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.58 29.05 1.36 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.297 -175.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -63.12 -55.81 22.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -175.788 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.473 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 5.3 p30 -80.86 -22.84 39.54 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.31 -39.48 93.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.394 177.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -81.6 -30.78 32.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.31 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -67.73 -31.2 70.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.755 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -86.76 -5.41 59.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.74 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.36 -175.657 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.502 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 65.3 m . . . . . 0 C--O 1.233 0.234 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 51.9 Cg_exo -53.83 148.53 37.03 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.057 1.838 . . . . 0.0 111.453 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.82 -29.93 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.925 0.393 . . . . 0.0 111.356 -172.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.09 -29.91 71.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.692 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 23.6 m95 -88.26 125.83 34.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.583 -174.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 8' ' ' ARG . 16.6 tpt180 -73.6 99.86 3.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.195 0.522 . . . . 0.0 110.063 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.37 129.46 39.83 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.86 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 85.9 t80 -132.69 105.79 7.39 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.426 177.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 56.96 -103.57 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.786 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.2 t -91.25 -37.94 12.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.626 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -92.65 174.33 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.136 0.493 . . . . 0.0 111.729 -173.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HB2' HG23 ' A' ' 128' ' ' ILE . 78.2 m -141.2 127.5 19.79 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.407 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.455 ' HH ' ' HG3' ' A' ' 46' ' ' GLU . 53.7 m-85 -120.58 127.25 51.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.386 -171.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.8 t80 -117.94 114.66 37.17 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.781 0.324 . . . . 0.0 110.408 176.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 5.2 Cg_endo -88.11 128.01 2.22 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.247 2.631 . . . . 0.0 112.075 176.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.05 138.57 48.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.009 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 p -89.43 2.69 54.14 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.527 0.68 . . . . 0.0 109.408 173.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 22' ' ' LYS . 3.9 t70 -66.48 133.52 50.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.002 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.686 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 16.5 p-10 -93.09 107.03 18.91 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.849 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.897 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 14.4 mptt -136.83 156.08 48.96 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.833 177.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.488 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 76.4 p -76.46 167.57 21.61 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.64 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.5 t90 -58.89 -39.2 80.73 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.941 0.4 . . . . 0.0 110.771 -176.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.09 76.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.186 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.97 -34.48 77.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.044 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.613 ' HG ' HD13 ' A' ' 38' ' ' LEU . 25.9 t -58.45 -46.33 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.866 178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -74.9 -22.46 58.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.76 0.314 . . . . 0.0 110.39 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -67.66 -45.81 74.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.782 0.325 . . . . 0.0 110.744 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.408 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.7 t-20 -71.97 -28.7 63.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.201 0.524 . . . . 0.0 109.949 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.508 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 65.3 m -84.13 177.13 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 33.2 t 75.33 -34.82 0.26 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.017 0.527 . . . . 0.0 110.919 -177.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 31' ' ' CYS . . . -61.67 -29.27 71.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.97 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.508 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.5 pmm? -100.47 10.51 41.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.331 . . . . 0.0 110.368 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.75 19.82 67.17 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.524 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.605 ' HB1' HG12 ' A' ' 128' ' ' ILE . . . -113.79 172.77 6.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.658 0.266 . . . . 0.0 111.39 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.465 ' HD2' ' OD1' ' A' ' 77' ' ' ASP . 71.3 m-70 -140.48 169.2 18.11 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.613 HD13 ' HG ' ' A' ' 27' ' ' SER . 4.1 mm? -52.44 141.02 20.86 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.371 0.419 . . . . 0.0 110.922 173.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.82 ' HE3' HG12 ' A' ' 41' ' ' ILE . 15.8 tpt -36.26 111.15 0.13 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.145 0.903 . . . . 0.0 112.439 177.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.595 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 12.0 p -111.89 89.01 2.94 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.522 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.82 HG12 ' HE3' ' A' ' 39' ' ' MET . 41.9 mt -64.65 114.83 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.486 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m -106.9 -22.78 12.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.832 -177.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 13.1 p -132.96 151.9 52.0 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.362 1.077 . . . . 0.0 113.182 -178.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.96 -50.63 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.548 -179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.426 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -59.36 -39.41 83.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.542 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.585 ' HB3' ' O ' ' A' ' 43' ' ' THR . 61.8 tt0 -48.5 -58.93 3.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.183 176.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.496 ' HA ' HG22 ' A' ' 50' ' ' ILE . 23.0 tt0 -61.18 -44.66 96.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.932 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -61.96 -25.42 67.6 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -177.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.426 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 27.5 m-85 -88.53 -37.81 15.42 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.3 tp -71.88 -30.01 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 120.381 -0.528 . . . . 0.0 111.103 -176.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.452 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.8 pt -69.44 -5.79 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.032 0.444 . . . . 0.0 111.196 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -87.22 -25.29 24.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.211 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -92.97 -23.81 18.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.494 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.7 mt -76.55 144.43 39.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.043 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.524 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -78.65 138.2 38.19 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.561 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 84.8 mtt180 -83.46 11.68 6.63 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -170.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.821 ' HG2' HD22 ' A' ' 58' ' ' LEU . 7.3 ptp180 -112.11 -11.08 13.84 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.755 176.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.821 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -100.22 166.91 10.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.271 0.558 . . . . 0.0 111.609 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.3 m -127.17 124.09 38.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.035 175.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.69 ' HB3' HG13 ' A' ' 125' ' ' ILE . 80.6 m-85 -109.07 121.95 46.23 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -169.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.439 ' HA ' HG11 ' A' ' 103' ' ' VAL . 19.1 m-85 -62.38 138.94 58.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.725 0.297 . . . . 0.0 111.791 177.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.612 HD23 HG11 ' A' ' 102' ' ' VAL . 1.4 mm? -110.92 173.36 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 174.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.621 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -87.73 60.65 4.19 Favored Glycine 0 C--O 1.225 -0.414 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.315 -177.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.457 HD23 ' HB ' ' A' ' 102' ' ' VAL . 3.3 mm? -109.55 126.42 53.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.724 0.262 . . . . 0.0 110.329 177.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' NH1' ' HB3' ' A' ' 67' ' ' GLU . 16.5 ttp85 -110.87 117.53 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.422 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -136.49 84.85 2.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.982 0.896 . . . . 0.0 108.998 164.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.597 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 3.3 tm-20 -91.15 123.82 34.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.499 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.548 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 3.2 t-20 71.28 19.94 5.19 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.867 0.73 . . . . 0.0 110.191 178.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.37 75.14 0.33 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.127 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.597 ' HZ1' ' CD ' ' A' ' 67' ' ' GLU . 52.0 mttp -101.95 -22.56 14.27 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.654 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 -8.17 62.79 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.568 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -86.07 65.14 8.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.554 0.692 . . . . 0.0 110.289 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -61.16 113.82 2.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.177 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -133.32 151.01 51.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.737 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.621 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 75.4 m95 -84.61 136.96 33.55 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.432 HG21 ' CZ2' ' A' ' 24' ' ' TRP . 10.5 t -79.2 47.98 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.662 0.744 . . . . 0.0 110.809 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.592 ' HB3' HG22 ' A' ' 40' ' ' THR . 33.9 t70 -162.09 32.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -178.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.76 -37.29 0.28 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.279 -1.328 . . . . 0.0 111.586 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.569 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 24.2 m -43.26 122.29 3.27 Favored Pre-proline 0 C--O 1.239 0.505 0 CA-C-O 121.531 0.681 . . . . 0.0 112.664 -176.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.8 Cg_exo -72.04 148.15 50.27 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 123.309 2.673 . . . . 0.0 111.644 174.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -69.86 127.91 34.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.253 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.471 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 0.9 OUTLIER -89.65 115.98 65.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.347 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.65 -29.15 36.73 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.63 2.22 . . . . 0.0 112.651 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -90.09 -22.56 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.802 0.334 . . . . 0.0 111.249 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.471 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 86.4 mtt180 -105.92 76.91 1.21 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.512 0.673 . . . . 0.0 110.484 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.0 p -136.41 131.02 47.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.944 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -126.39 52.05 1.76 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.909 -168.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.41 ' CH2' HG21 ' A' ' 102' ' ' VAL . 85.8 m95 -64.81 177.95 0.87 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.454 0.645 . . . . 0.0 111.372 178.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.478 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 91.0 m-70 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.536 172.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.471 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.2 p-10 . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 121.529 0.68 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.37 166.34 28.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.464 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.612 HG11 HD23 ' A' ' 62' ' ' LEU . 59.1 t -95.71 139.88 18.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -169.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.439 HG11 ' HA ' ' A' ' 61' ' ' PHE . 32.6 m -123.9 141.45 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.718 168.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.51 ' N ' HD21 ' A' ' 62' ' ' LEU . 13.9 tp -81.53 109.99 16.5 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.38 140.46 49.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.57 -172.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.561 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 66.5 t80 -88.25 96.09 10.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.478 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 49.5 t-20 -129.33 128.53 43.31 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -176.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 61.45 38.79 15.67 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.856 0.722 . . . . 0.0 109.987 -175.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 10.5 m-20 65.56 16.9 10.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.246 -1.343 . . . . 0.0 113.15 174.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 110' ' ' LYS . 10.9 ptmm? -132.49 137.09 47.08 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.903 172.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.452 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -70.8 130.35 41.46 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 170.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -157.0 168.81 26.38 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.471 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.403 ' HB3' HG12 ' A' ' 102' ' ' VAL . 37.0 m0 -79.15 142.16 36.61 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.292 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -136.25 122.17 20.04 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 13.5 t70 -84.17 123.6 30.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.702 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.448 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 21.3 m -139.23 159.94 64.27 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.458 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.45 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 13.1 Cg_endo -57.38 131.32 44.04 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.53 2.153 . . . . 0.0 111.942 175.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 69.5 m -67.19 -12.75 60.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.19 0.519 . . . . 0.0 110.657 177.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -85.77 -2.78 58.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.55 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.45 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 83.5 t80 -88.0 138.35 31.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.109 175.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.96 135.91 33.73 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.906 0.384 . . . . 0.0 110.252 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.418 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -154.14 -173.21 4.49 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.969 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 39.2 m -74.29 160.45 31.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.985 0.421 . . . . 0.0 110.088 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.897 ' HD2' ' HB2' ' A' ' 22' ' ' LYS . 48.4 mtp180 -127.26 145.85 50.63 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.587 -169.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.69 HG13 ' HB3' ' A' ' 60' ' ' TYR . 59.0 mt -124.65 119.63 56.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 166.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . 0.475 ' SG ' ' HB2' ' A' ' 36' ' ' ALA . 3.8 t -108.54 132.8 53.47 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -112.91 126.54 55.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.075 0.464 . . . . 0.0 111.961 -174.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.605 HG12 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -111.38 134.74 21.09 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.941 175.562 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.437 ' HD2' HD11 ' A' ' 128' ' ' ILE . 6.6 Cg_exo -74.11 158.63 45.35 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.113 1.875 . . . . 0.0 111.164 173.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.41 49.59 2.33 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.9 t -111.12 18.08 19.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.08 0.467 . . . . 0.0 110.521 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.2 m -60.53 -21.91 63.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.227 0.536 . . . . 0.0 111.258 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.543 ' H ' HD13 ' A' ' 133' ' ' LEU . 3.9 mp -75.91 -28.9 58.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.102 179.121 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -87.82 -43.17 12.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.871 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . 0.521 ' HB2' ' HB3' ' A' ' 138' ' ' LEU . . . -85.79 61.13 6.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.172 -177.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -43.37 74.2 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.2 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -74.8 -30.08 61.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.521 ' HB3' ' HB2' ' A' ' 135' ' ' ALA . 3.1 tt -64.91 -45.28 86.53 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.82 -30.55 71.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.278 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -71.95 -35.64 69.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.812 178.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -86.64 -6.11 58.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.998 -176.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.252 1.226 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.785 -177.618 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.762 ' SG ' ' HD2' ' A' ' 4' ' ' PRO . 3.0 t . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.762 ' HD2' ' SG ' ' A' ' 3' ' ' CYS . 18.5 Cg_endo -64.96 119.42 6.45 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 N-CA-C 108.859 -1.247 . . . . 0.0 108.859 164.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.435 HG21 ' N ' ' A' ' 6' ' ' ASP . 5.3 mp 60.19 159.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -166.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.435 ' N ' HG21 ' A' ' 5' ' ' ILE . 10.7 t70 -79.96 72.76 6.74 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.117 -0.989 . . . . 0.0 110.394 -177.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 10.4 m0 -73.23 155.34 39.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.179 174.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -72.87 102.07 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.067 0.461 . . . . 0.0 110.063 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -87.19 124.91 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.112 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.45 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 66.9 t80 -120.36 110.98 17.18 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.177 174.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 66.88 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.101 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -149.07 17.33 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.926 0.393 . . . . 0.0 110.625 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.466 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 36.8 m-80 -125.92 151.01 47.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.463 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.733 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 80.3 m -106.25 135.03 48.45 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.325 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.45 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 27.7 m-85 -129.24 134.72 48.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.444 ' HD2' HD22 ' A' ' 18' ' ' LEU . 8.4 t80 -123.73 113.23 28.77 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -89.68 118.35 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.533 2.822 . . . . 0.0 111.858 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.484 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -132.24 140.47 48.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.371 0.605 . . . . 0.0 110.389 178.373 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 p -86.99 5.29 38.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.299 -169.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.4 ' OD1' ' HB2' ' A' ' 18' ' ' LEU . 2.8 m-20 -59.56 135.04 57.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.052 0.453 . . . . 0.0 110.174 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.667 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 2.1 p-10 -96.28 102.3 14.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.022 -176.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.667 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 13.4 mmmt -137.07 155.52 49.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 179.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.7 p -70.72 178.98 2.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.834 -176.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.538 ' CZ2' HG22 ' A' ' 76' ' ' VAL . 49.4 t90 -56.54 -52.7 63.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.12 0.486 . . . . 0.0 110.444 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -67.04 -43.72 82.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.293 -177.294 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.28 -31.54 64.13 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -174.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 p -67.26 -35.26 79.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.581 175.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' HB2' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -66.25 -30.98 71.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.739 173.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 11.1 mmt-85 -83.24 -25.59 31.55 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.105 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.518 ' O ' ' HE1' ' A' ' 34' ' ' MET . 3.2 t-20 -77.61 -26.39 50.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.7 m -85.87 178.88 7.15 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 166.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.731 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 6.9 p 81.39 -41.23 0.15 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.79 0.836 . . . . 0.0 111.565 172.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.81 -23.09 58.49 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 116.202 -0.454 . . . . 0.0 113.008 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.518 ' HE1' ' O ' ' A' ' 30' ' ' ASN . 1.3 pmm? -100.62 15.73 27.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.658 0.266 . . . . 0.0 110.914 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.18 47.59 7.43 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.2 -175.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.731 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -142.98 -174.37 4.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.835 0.35 . . . . 0.0 110.649 -173.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.651 ' CD2' ' HB2' ' A' ' 77' ' ' ASP . 9.6 t60 -148.48 162.16 40.18 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 171.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 28' ' ' GLU . 21.9 tp -56.95 145.73 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.734 ' HE3' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -60.4 113.67 2.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.542 0.686 . . . . 0.0 112.443 -173.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.754 ' HB ' HG13 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -106.92 109.71 21.67 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.252 170.164 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.734 HG12 ' HE3' ' A' ' 39' ' ' MET . 54.2 mt -64.6 111.68 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.975 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.1 m -97.16 -31.65 12.35 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.787 -174.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 21.9 p -128.04 153.27 46.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.85 0.833 . . . . 0.0 112.433 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.436 ' CG ' ' HG2' ' A' ' 85' ' ' ARG . 19.3 mt-10 -66.69 -36.12 81.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.965 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.11 79.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.033 0.444 . . . . 0.0 110.425 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.552 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.8 tt0 -55.58 -54.54 42.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.406 ' O ' HG23 ' A' ' 51' ' ' ILE . 21.5 tm0? -57.74 -48.86 78.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.641 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -64.02 -27.73 69.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.277 -176.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -89.23 -41.24 12.32 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.9 tp -62.51 -35.52 70.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 -176.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.642 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 41.5 pt -68.1 -9.22 10.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.497 -178.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -82.81 -30.0 29.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.24 -28.8 25.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.694 -178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 69.4 mt -62.86 158.02 20.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.504 ' OD2' ' HB3' ' A' ' 57' ' ' ARG . 15.8 t70 -78.88 -2.45 39.92 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.994 -1.003 . . . . 0.0 112.975 -171.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.71 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 10.9 mpt_? 64.94 -57.51 0.27 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -172.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.504 ' HB3' ' OD2' ' A' ' 55' ' ' ASP . 13.5 ttp180 -61.99 -27.73 69.07 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 122.982 0.513 . . . . 0.0 111.864 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.51 147.32 24.04 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.367 0.603 . . . . 0.0 112.243 -175.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.9 m -100.93 130.54 46.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.72 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.454 ' HA ' ' O ' ' A' ' 123' ' ' SER . 86.2 m-85 -112.94 124.34 52.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -174.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -69.99 127.93 34.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.033 174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -169.71 -177.48 2.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.648 179.334 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.405 ' HA2' ' CZ3' ' A' ' 75' ' ' TRP . . . 83.77 -115.03 3.98 Favored Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 115.23 0.852 . . . . 0.0 115.23 163.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 75' ' ' TRP . 3.2 mm? -93.67 154.32 17.88 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.132 -0.534 . . . . 0.0 110.577 -170.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 14.0 ttm180 -93.6 104.33 16.45 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.727 ' HB2' ' HA ' ' A' ' 101' ' ' CYS . 5.4 m-20 -97.0 75.4 2.64 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.993 0.902 . . . . 0.0 108.778 178.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.623 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 13.8 tt0 -112.39 121.16 44.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 114.574 -1.193 . . . . 0.0 110.624 -171.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.543 ' HB3' ' HZ1' ' A' ' 70' ' ' LYS . 3.0 t-20 67.86 15.87 9.61 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.469 0.48 . . . . 0.0 110.688 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.91 35.1 24.85 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.492 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 23.8 mttm -64.46 137.21 57.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.407 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -68.59 -15.32 68.38 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.064 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -86.95 86.0 7.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.664 ' HZ3' ' HA ' ' A' ' 66' ' ' ASP . 71.9 m95 -75.54 133.7 40.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.09 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.544 HH21 ' HA ' ' A' ' 78' ' ' GLN . 73.2 ttt180 -150.47 149.11 29.56 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.473 ' HA ' HD12 ' A' ' 64' ' ' LEU . 78.0 m95 -69.66 169.92 11.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.34 0.591 . . . . 0.0 111.01 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.754 HG13 ' HB ' ' A' ' 40' ' ' THR . 8.8 p -62.57 -19.31 22.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.714 -178.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.651 ' HB2' ' CD2' ' A' ' 37' ' ' HIS . 20.5 t70 -147.67 103.57 3.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.471 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.544 ' HA ' HH21 ' A' ' 74' ' ' ARG . 45.4 tp60 64.88 -64.68 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.421 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 7.4 m -42.99 127.89 3.25 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 124.206 1.002 . . . . 0.0 112.963 -173.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.7 Cg_exo -74.89 159.68 41.44 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.087 2.525 . . . . 0.0 111.687 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -54.64 133.07 46.57 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.752 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 11.0 t-20 -103.97 128.4 27.29 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.658 -175.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.3 Cg_exo -67.92 -36.25 18.46 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.01 2.474 . . . . 0.0 113.904 -177.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 33.0 ttp180 -96.13 -34.73 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.623 -176.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.436 ' HG2' ' CG ' ' A' ' 44' ' ' GLU . 95.8 mtt180 -93.14 25.4 3.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.301 0.572 . . . . 0.0 110.814 -172.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 86' ' ' VAL . 6.0 p -90.88 95.39 5.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.978 0.894 . . . . 0.0 109.619 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.25 73.36 10.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.291 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 25.5 m95 -66.75 166.64 12.73 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.499 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.574 ' NE2' ' HB3' ' A' ' 107' ' ' ASN . 6.2 t-80 . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.537 -172.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.668 ' HB2' ' OD2' ' A' ' 115' ' ' ASP . 4.6 p-10 . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.111 0.482 . . . . 0.0 110.311 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.727 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 93.2 m -46.86 131.21 11.99 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.077 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.84 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 10.4 m -80.14 144.17 11.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.582 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.685 HG11 ' HE1' ' A' ' 120' ' ' PHE . 28.0 m -130.62 150.01 34.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.787 170.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.547 ' HB2' HD21 ' A' ' 62' ' ' LEU . 14.7 tp -83.88 110.53 18.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.404 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 11.1 p -134.46 152.31 33.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 -176.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.699 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 20.0 t80 -87.61 96.85 10.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.649 177.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.574 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 57.6 t30 -133.65 145.59 50.11 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 63.89 16.06 9.57 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.432 0.457 . . . . 0.0 110.414 -176.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.8 t70 78.0 19.55 1.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.136 0.897 . . . . 0.0 111.624 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.44 ' HB3' ' HE3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -141.74 156.29 45.61 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.391 -0.818 . . . . 0.0 111.599 173.643 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.71 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.7 m95 -85.54 128.54 34.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.716 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.563 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -165.27 174.46 10.16 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.64 175.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.84 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 30.3 m0 -80.17 124.48 28.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.97 0.414 . . . . 0.0 111.165 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 8.0 t-20 -99.55 142.25 31.27 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.372 176.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.668 ' OD2' ' HB2' ' A' ' 100' ' ' ASN . 14.4 t70 -84.84 122.65 29.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.414 HG22 ' CE1' ' A' ' 120' ' ' PHE . 0.6 OUTLIER -151.27 149.04 23.66 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 111.54 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.445 ' O ' ' HB3' ' A' ' 120' ' ' PHE . 8.2 Cg_endo -53.01 144.84 44.06 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.883 2.389 . . . . 0.0 111.52 172.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 26.4 m -81.97 -14.41 56.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.576 -170.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -80.4 -8.95 59.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.459 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.685 ' HE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -74.07 133.62 42.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 170.854 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -112.73 146.26 39.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.471 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.44 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.45 -168.6 3.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.365 -176.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 8.5 t -69.35 166.66 18.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.67 HH11 ' HB2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -153.35 161.84 41.91 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -168.152 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.1 mt -136.55 133.94 49.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.101 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 75.8 m -102.6 142.25 34.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 173.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -121.81 136.01 54.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.852 0.358 . . . . 0.0 110.807 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.733 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 56.2 mt -125.23 135.28 26.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.754 177.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.19 157.21 29.94 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.065 1.843 . . . . 0.0 111.45 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.24 58.19 1.92 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.464 179.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.0 t -69.26 -20.9 63.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 111.568 0.211 . . . . 0.0 111.568 -176.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.6 m -66.09 -26.54 67.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.142 0.496 . . . . 0.0 110.617 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.471 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.8 mp -90.32 -20.84 22.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.368 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.01 -28.46 22.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.429 0.633 . . . . 0.0 109.35 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.67 39.31 0.95 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.716 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -49.56 71.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.851 -174.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -83.2 -26.8 30.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.011 0.434 . . . . 0.0 110.267 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 58.1 mt -62.54 -52.59 62.85 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.601 178.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -75.05 -19.3 60.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.279 0.562 . . . . 0.0 110.057 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.02 -39.71 95.56 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -87.76 -44.53 11.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.271 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.46 -177.764 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.2 m . . . . . 0 C--O 1.234 0.253 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 41.1 Cg_exo -57.27 149.15 66.28 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.489 2.126 . . . . 0.0 112.155 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.74 -14.84 18.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.403 0.621 . . . . 0.0 111.132 -176.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.7 -30.61 67.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.262 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.536 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 23.0 m95 -90.96 161.47 15.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.015 -173.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 50.3 mmt-85 -115.7 136.19 53.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.931 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -102.91 135.83 43.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.916 0.389 . . . . 0.0 111.579 -176.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.418 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 73.6 t80 -137.97 110.18 7.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.621 175.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 66.0 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.209 -176.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.6 m -151.92 30.19 0.57 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.268 0.556 . . . . 0.0 109.759 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 17.7 m-80 -129.02 149.9 50.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.384 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 85.5 m -124.89 127.14 46.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 109.928 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.418 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 5.6 m-85 -117.0 141.59 48.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.194 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.536 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 26.4 t80 -128.74 114.9 19.25 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-O 120.73 0.3 . . . . 0.0 110.367 175.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -88.79 138.41 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.998 2.465 . . . . 0.0 112.23 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.426 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 5.1 mp -122.48 149.66 43.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.093 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 20' ' ' ASP . 2.6 p -101.16 66.29 1.12 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.886 -167.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.431 ' HA ' ' C ' ' A' ' 122' ' ' ALA . 32.0 t70 81.42 178.39 0.08 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.708 165.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 0.5 OUTLIER 86.57 15.23 0.11 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.569 1.147 . . . . 0.0 112.326 174.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.807 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 70.0 mmtt -139.28 148.23 42.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.95 0.405 . . . . 0.0 111.376 176.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.6 p -85.17 172.2 11.39 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 75.4 t90 -62.16 -39.96 94.37 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.502 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.09 -58.14 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.229 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.807 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 52.2 mm-40 -56.7 -37.75 71.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.538 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.505 ' HB3' HD22 ' A' ' 38' ' ' LEU . 71.7 m -54.59 -50.73 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.538 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HA ' ' HB2' ' A' ' 31' ' ' CYS . 9.0 tp10 -81.11 -21.66 39.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.737 0.303 . . . . 0.0 110.767 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 99.2 mtt180 -65.67 -42.98 90.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.074 0.464 . . . . 0.0 110.066 172.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -74.59 -28.22 60.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.226 178.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.434 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 81.4 m -84.33 178.54 7.73 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.149 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 61.2 m 71.78 -45.66 0.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.67 0.388 . . . . 0.0 111.077 -174.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.96 -18.39 70.66 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.2 -0.524 . . . . 0.0 111.965 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.6 mtm -97.99 3.82 49.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.329 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.9 89.45 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.89 -0.672 . . . . 0.0 111.891 -175.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -100.36 -176.58 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.722 -0.239 . . . . 0.0 110.873 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -149.31 165.09 33.02 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.505 HD22 ' HB3' ' A' ' 27' ' ' SER . 33.2 mt -60.32 144.81 49.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.069 0.461 . . . . 0.0 111.442 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.639 ' HE1' HG12 ' A' ' 41' ' ' ILE . 0.5 OUTLIER -57.79 120.02 7.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.982 -175.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.529 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 53.9 p -116.86 101.91 8.94 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.646 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.639 HG12 ' HE1' ' A' ' 39' ' ' MET . 39.2 mt -64.8 109.2 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.212 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 m -95.78 -37.83 10.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.462 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.9 p -125.66 154.09 42.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.545 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -68.39 -30.23 69.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.449 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.38 -47.27 86.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.198 175.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -53.18 -47.35 68.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.277 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -60.82 -53.57 55.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.15 176.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -57.81 -31.02 66.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.433 -174.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.449 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 34.1 m-85 -82.56 -39.24 22.56 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.7 tp -73.28 -32.22 36.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.576 -0.45 . . . . 0.0 111.35 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.412 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 34.6 pt -69.34 -9.07 11.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.478 . . . . 0.0 111.234 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -78.64 -27.42 45.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.161 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -91.51 -27.67 18.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.801 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.0 mt -68.95 134.32 49.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.663 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.419 ' HB3' HD21 ' A' ' 58' ' ' LEU . 12.7 t70 -61.5 128.74 37.78 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 171.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.564 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 64.9 mtt180 -85.48 32.02 0.58 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -168.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.829 ' HG2' HD23 ' A' ' 58' ' ' LEU . 2.0 ptp180 -127.03 -24.45 3.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.507 174.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.829 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -86.31 162.3 18.3 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.277 0.561 . . . . 0.0 112.074 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 p -112.55 112.74 24.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.552 ' HB3' HG13 ' A' ' 125' ' ' ILE . 62.7 m-85 -99.36 120.74 40.07 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.692 ' HA ' HG11 ' A' ' 103' ' ' VAL . 24.3 m-85 -59.12 128.99 39.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.071 0.462 . . . . 0.0 111.734 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.8 HD13 ' HG ' ' A' ' 104' ' ' LEU . 98.9 mt -103.53 157.43 17.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.194 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.588 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -78.98 39.39 2.03 Favored Glycine 0 C--O 1.223 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 113.333 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.619 ' HB3' HG23 ' A' ' 102' ' ' VAL . 33.2 tp -105.04 116.35 31.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.414 0.607 . . . . 0.0 109.621 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.3 ttt85 -115.03 127.73 55.83 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -172.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -122.91 107.37 11.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.688 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.4 tt0 -99.71 118.73 36.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.679 -172.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.0 m120 69.0 21.5 7.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.431 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.94 70.07 0.68 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.687 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 61.1 mttp -91.59 -16.77 26.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.949 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.77 12.63 82.8 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -109.43 74.99 0.92 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.058 -0.571 . . . . 0.0 109.656 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.642 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.7 m95 -66.68 104.23 1.26 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 178.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -123.68 144.62 49.53 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 -174.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TRP . . . . . 0.588 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 89.8 m95 -85.99 131.66 34.23 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.1 p -57.82 -27.92 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.989 -175.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.487 ' HB3' HG23 ' A' ' 40' ' ' THR . 2.3 t70 -55.92 -62.43 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.039 173.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 77' ' ' ASP . 21.8 tm0? 163.44 -29.89 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.411 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.6 m -42.08 121.74 2.48 Favored Pre-proline 0 C--O 1.235 0.333 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.09 -178.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -66.96 161.28 43.2 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.647 2.231 . . . . 0.0 111.385 173.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.642 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 56.5 t80 -69.02 142.46 54.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.833 -178.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.465 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 45.0 m-80 -103.1 96.84 8.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.305 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 17.7 Cg_exo -67.33 -29.85 37.75 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.519 2.146 . . . . 0.0 111.539 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -81.04 -11.66 59.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.629 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ARG . . . . . 0.465 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 92.2 mtt180 -129.44 55.51 1.76 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.176 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.73 138.06 27.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.924 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -130.77 71.6 1.47 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.298 -177.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -75.84 168.95 19.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.456 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 3.9 m-70 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.024 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.38 0.61 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.11 148.24 28.06 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.306 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.619 HG23 ' HB3' ' A' ' 64' ' ' LEU . 20.9 m -88.56 147.21 5.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.209 0.528 . . . . 0.0 111.344 -176.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.692 HG11 ' HA ' ' A' ' 61' ' ' PHE . 34.5 m -118.59 152.76 20.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.411 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.8 ' HG ' HD13 ' A' ' 62' ' ' LEU . 17.4 mt -83.09 103.41 12.5 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.01 138.34 53.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.488 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -87.71 96.52 10.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.478 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASN . . . . . 0.456 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 62.2 t30 -140.88 147.17 38.49 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 64.4 24.25 13.15 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.648 0.593 . . . . 0.0 109.705 -172.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 66.59 22.6 10.5 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.315 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -134.41 151.31 51.11 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.969 -0.457 . . . . 0.0 111.199 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TRP . . . . . 0.564 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 81.9 m95 -88.71 108.6 19.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.509 171.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -143.45 165.76 26.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.93 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.573 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.3 m0 -78.0 125.67 29.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.39 -177.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -121.99 125.7 46.9 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.44 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 20.0 t70 -84.17 128.08 34.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.213 0.53 . . . . 0.0 111.744 -173.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.59 159.03 69.21 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.552 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.546 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.4 Cg_endo -55.85 137.93 80.23 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.384 2.056 . . . . 0.0 111.929 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 90.1 m -69.74 -9.1 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -178.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -98.85 13.24 33.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.627 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.546 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 61.9 t80 -89.08 140.36 29.53 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.611 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -82.57 125.13 30.81 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 177.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.534 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -157.49 -167.25 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.044 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 20' ' ' ASP . 20.0 m -84.46 175.04 9.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . 0.426 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 1.1 ptm180 -154.83 155.43 34.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.761 0.315 . . . . 0.0 111.733 -173.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.552 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.2 mt -127.9 123.82 61.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.9 t -106.53 134.84 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -119.09 125.76 50.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.94 -177.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ILE . . . . . 0.426 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 11.0 tt -112.08 141.39 24.86 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -68.51 146.5 68.18 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 121.886 1.724 . . . . 0.0 111.029 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.415 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -73.54 63.12 1.87 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.712 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.0 t -80.92 22.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.813 0.816 . . . . 0.0 110.946 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.525 ' O ' ' HB3' ' A' ' 136' ' ' GLU . 5.9 t -66.99 -11.25 56.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.385 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 133' ' ' LEU . 1.9 pt? -74.38 -41.35 61.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.333 0.587 . . . . 0.0 109.989 176.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -87.83 -46.77 9.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.869 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.02 21.0 3.89 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.525 ' HB3' ' O ' ' A' ' 132' ' ' THR . 0.0 OUTLIER -58.58 -59.32 5.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.738 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -71.86 -26.69 62.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.122 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.95 -48.32 76.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -70.99 -25.58 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.146 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -70.32 -39.66 74.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.866 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -75.11 -7.37 53.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.366 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.669 177.582 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 4.4 p -103.88 118.51 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 170.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.421 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 78.4 m -148.05 156.45 43.69 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.724 -173.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.459 ' O ' ' HD1' ' A' ' 7' ' ' TRP . 59.6 Cg_endo -73.23 128.44 12.94 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.696 2.264 . . . . 0.0 114.752 -172.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mt 65.15 -98.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.735 167.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -114.56 9.79 16.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 111.849 -164.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.532 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.5 m95 -68.29 119.7 13.25 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 52.7 mmt-85 -72.68 112.11 8.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.689 0.281 . . . . 0.0 110.77 -175.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.83 121.64 24.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -139.72 121.69 15.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 60.02 -99.57 0.09 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.398 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 -11.92 9.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.93 0.395 . . . . 0.0 110.492 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -97.46 174.14 6.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.911 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.532 ' HB3' ' HB3' ' A' ' 7' ' ' TRP . 79.5 m -137.79 131.34 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.505 175.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -120.62 123.86 43.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.872 -174.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 75.5 t80 -118.53 116.95 34.76 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.177 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.5 Cg_endo -84.93 135.33 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.156 2.571 . . . . 0.0 112.358 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.462 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.7 mp -122.73 139.35 54.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 p -108.03 22.83 15.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.13 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -87.47 170.32 11.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.123 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -96.04 115.92 28.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.398 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.537 ' HA ' ' HZ2' ' A' ' 22' ' ' LYS . 3.5 mmpm? -148.31 146.58 28.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.8 p -73.99 167.44 21.51 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.62 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 57.9 t90 -65.96 -35.14 79.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.54 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.97 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 31.8 mt-10 -76.86 -32.03 57.22 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.508 ' HB2' HD23 ' A' ' 38' ' ' LEU . 7.1 p -68.55 -39.6 81.03 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.576 177.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.9 -33.67 76.37 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.926 173.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.448 ' HB3' ' HA ' ' A' ' 26' ' ' GLU . 8.2 ttt180 -73.03 -42.05 63.57 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.099 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.48 -32.0 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.246 0.546 . . . . 0.0 109.999 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 32' ' ' SER . 87.9 m -84.82 178.15 7.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 170.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.666 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 40.2 m 75.86 -44.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.729 0.412 . . . . 0.0 111.061 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.96 -23.9 66.27 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.955 173.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -91.05 7.27 41.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.688 0.28 . . . . 0.0 110.608 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.13 90.7 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.44 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -101.44 -176.39 3.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.344 -0.428 . . . . 0.0 111.026 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.719 ' CD2' ' HA ' ' A' ' 77' ' ' ASP . 57.9 m-70 -143.76 170.66 15.45 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 174.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.508 HD23 ' HB2' ' A' ' 27' ' ' SER . 61.1 mt -68.15 163.12 23.32 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.264 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.937 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.4 tpt -53.85 102.33 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.27 0.557 . . . . 0.0 111.799 -177.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.561 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 18.3 p -105.55 104.95 14.77 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.127 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.545 HG12 ' HE3' ' A' ' 39' ' ' MET . 55.5 mt -74.8 95.32 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.892 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.98 -41.26 36.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.868 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 44.9 p -123.65 161.18 25.58 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.907 0.861 . . . . 0.0 111.675 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.93 -16.47 64.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.876 175.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.848 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -79.67 -38.23 34.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.215 174.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -48.38 -49.37 34.89 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.45 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -66.56 -56.36 11.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.857 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.848 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.7 p30 -65.97 -25.14 66.97 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -170.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -87.26 -35.0 18.74 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.615 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -71.45 -31.72 43.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 120.271 -0.572 . . . . 0.0 111.201 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.4 pt -71.48 -4.67 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.935 0.397 . . . . 0.0 111.111 -179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -86.91 -19.46 28.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.645 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.13 -17.48 17.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.235 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.8 mt -82.83 144.19 30.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.287 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.94 133.34 40.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.982 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -76.43 53.26 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.786 -175.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -162.47 -31.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.201 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.612 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -87.17 158.97 19.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.22 0.534 . . . . 0.0 111.267 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.8 m -110.51 121.02 44.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.223 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.662 ' HB3' HG13 ' A' ' 125' ' ' ILE . 84.0 m-85 -107.4 123.74 48.81 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.794 ' HA ' HG13 ' A' ' 103' ' ' VAL . 49.2 m-85 -57.89 137.99 56.17 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.737 HD22 ' HG ' ' A' ' 104' ' ' LEU . 85.1 mt -105.14 163.66 12.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.249 173.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.44 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.62 14.75 34.31 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.623 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.529 ' HG ' ' CE2' ' A' ' 75' ' ' TRP . 1.1 mt -82.66 116.81 22.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.301 0.55 . . . . 0.0 110.195 178.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.62 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 11.1 ttm180 -113.26 126.26 55.21 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.434 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 12.6 t70 -123.89 145.82 48.85 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 156.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.529 ' HG3' ' HD2' ' A' ' 70' ' ' LYS . 4.8 pt-20 -120.63 6.24 10.54 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -162.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.416 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 179.87 29.92 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.917 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 59.7 38.26 21.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.538 0.685 . . . . 0.0 109.456 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.529 ' HD2' ' HG3' ' A' ' 67' ' ' GLU . 96.8 mttt -81.92 -22.85 36.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.074 -173.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 19.66 56.69 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -175.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -100.39 63.59 1.12 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.198 -0.501 . . . . 0.0 110.253 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.414 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.8 m95 -70.06 104.35 2.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.679 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.8 mtm180 -134.11 141.1 47.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.407 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.561 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 79.9 m95 -88.55 125.27 34.7 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 6.2 p -70.63 82.62 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-O 122.141 0.972 . . . . 0.0 110.326 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.719 ' HA ' ' CD2' ' A' ' 37' ' ' HIS . 2.1 t70 -172.88 -59.54 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.591 -174.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 163.34 -31.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.888 1.368 . . . . 0.0 107.615 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.471 ' O ' ' HB2' ' A' ' 75' ' ' TRP . 26.3 m -59.98 120.18 48.14 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.925 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -75.49 169.18 22.92 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 123.023 2.482 . . . . 0.0 111.287 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.414 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 61.3 t80 -64.84 125.38 24.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.707 0.289 . . . . 0.0 110.444 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.549 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 4.3 m-80 -80.06 110.49 16.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.4 -31.33 17.88 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.694 2.263 . . . . 0.0 112.307 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.7 -11.91 40.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.524 -178.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.549 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 76.3 mtt180 -127.91 80.39 1.96 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.994 0.426 . . . . 0.0 111.283 -175.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -121.64 98.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -98.94 69.0 1.75 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -65.8 150.03 49.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.953 0.406 . . . . 0.0 111.007 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.489 ' CD2' ' HB2' ' A' ' 112' ' ' ALA . 8.7 t-80 -64.79 -51.21 63.43 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.478 ' HZ2' ' CD ' ' A' ' 92' ' ' GLU . 22.4 pttm 175.79 -159.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -72.43 74.89 1.04 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 168.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.478 ' CD ' ' HZ2' ' A' ' 90' ' ' LYS . 4.4 tp10 -91.79 120.25 68.09 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.806 -170.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -72.06 -50.6 0.25 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.745 2.296 . . . . 0.0 111.658 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.4 t70 55.17 -97.4 0.07 Allowed 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.933 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 175.75 -8.73 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 115' ' ' ASP . 28.0 t -41.82 118.95 1.19 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.502 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -164.73 149.42 9.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.808 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.9 -110.29 2.99 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.108 -1.044 . . . . 0.0 110.695 -175.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.612 ' HG2' ' H ' ' A' ' 118' ' ' CYS . 6.3 pm0 -88.74 138.3 31.54 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 174.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.434 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 5.1 p30 -133.23 122.8 24.47 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 110.994 -175.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 73.1 m -130.04 127.26 39.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.465 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.565 HG11 ' HB3' ' A' ' 115' ' ' ASP . 30.4 m -81.63 145.67 8.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 0.0 111.59 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.794 HG13 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -128.2 155.46 39.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.009 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.737 ' HG ' HD22 ' A' ' 62' ' ' LEU . 25.9 mt -86.43 105.83 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 171.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.99 141.32 35.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 53.7 t80 -93.09 96.62 10.17 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.021 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.476 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 45.5 t-20 -138.83 140.46 38.51 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.38 27.24 16.89 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 5.5 m-20 62.14 17.06 8.84 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.127 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -121.6 133.37 54.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.383 0.611 . . . . 0.0 111.302 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -79.77 124.98 29.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.071 171.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.489 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . . . -163.56 170.12 17.7 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.595 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -73.65 125.81 28.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.242 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.45 ' OD1' ' HG2' ' A' ' 92' ' ' GLU . 4.2 t30 -124.59 120.25 31.37 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.565 ' HB3' HG11 ' A' ' 102' ' ' VAL . 10.5 p-10 -89.79 124.85 35.01 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.465 0.65 . . . . 0.0 110.378 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.38 159.4 69.45 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.965 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 96' ' ' SER . 5.5 Cg_endo -49.57 128.55 21.16 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.52 2.147 . . . . 0.0 110.781 172.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.612 ' H ' ' HG2' ' A' ' 99' ' ' GLU . 10.6 m -74.07 -4.09 33.42 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.901 0.382 . . . . 0.0 111.446 -173.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -90.44 0.5 57.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.552 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -82.99 140.97 32.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.87 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -93.05 132.2 37.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.105 0.479 . . . . 0.0 111.153 177.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -152.9 -171.4 3.92 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.343 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 36.2 m -81.2 170.31 16.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.462 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 14.2 ptt180 -149.08 159.85 43.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.201 0.524 . . . . 0.0 112.32 -171.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.937 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 39.9 mt -123.55 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.1 t -112.33 130.4 55.96 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -115.63 123.89 49.55 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.655 -176.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.45 HG22 ' HB2' ' A' ' 14' ' ' CYS . 13.8 tt -114.06 135.83 22.14 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 176.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.72 167.02 22.26 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.413 2.075 . . . . 0.0 111.015 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.9 54.1 2.15 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.058 177.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.7 t -88.06 2.22 52.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.055 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.3 m -61.9 -26.86 68.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.034 0.445 . . . . 0.0 110.487 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.92 -30.07 69.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.301 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -87.5 -14.51 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.203 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.556 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -90.76 22.03 3.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.936 -175.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.553 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -64.41 -63.65 1.08 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.166 -0.214 . . . . 0.0 111.426 -176.469 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.553 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 37.7 m-80 -85.18 -23.7 28.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.982 0.42 . . . . 0.0 110.138 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.556 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 2.3 tm? -58.96 -54.88 42.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.928 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.675 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 56.5 t80 -75.58 -20.35 58.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.058 0.456 . . . . 0.0 110.343 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -66.32 -28.33 68.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 0.0 109.851 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -86.95 -31.15 20.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.65 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' SER . . . . . 0.675 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 99.0 p . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.462 -171.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.427 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.3 m -140.56 148.7 21.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 p -116.52 123.92 30.03 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.423 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 12.6 Cg_exo -70.91 170.5 17.81 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.841 2.36 . . . . 0.0 111.401 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.514 HD11 ' H ' ' A' ' 5' ' ' ILE . 0.2 OUTLIER -61.68 -10.34 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.917 0.389 . . . . 0.0 111.193 176.296 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.37 -35.63 81.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.191 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.423 ' CD1' ' HD2' ' A' ' 4' ' ' PRO . 16.2 m95 -84.85 142.78 29.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.301 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -85.19 107.34 17.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.801 0.334 . . . . 0.0 110.171 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.39 135.48 39.48 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.86 178.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.441 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 78.5 t80 -133.8 110.09 9.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.547 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 67.64 -68.42 0.16 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.041 0.838 . . . . 0.0 110.932 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 p -145.88 -28.24 0.43 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.94 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -86.37 170.95 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.912 0.386 . . . . 0.0 111.15 -174.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.544 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 8.3 m -123.23 132.7 54.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.773 -176.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.457 ' CE1' ' HB2' ' A' ' 127' ' ' LYS . 90.2 m-85 -129.03 129.89 45.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.732 0.301 . . . . 0.0 111.519 -174.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.406 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 59.6 t80 -129.5 117.79 18.79 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.891 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -88.58 136.33 3.21 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.293 2.662 . . . . 0.0 112.262 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.58 137.81 52.35 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.8 p -91.05 -4.17 56.58 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.104 0.478 . . . . 0.0 111.061 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' HA ' ' A' ' 123' ' ' SER . 16.3 t70 -77.22 154.01 33.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.935 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.478 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 43.3 m-80 -108.5 140.2 42.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.712 0.291 . . . . 0.0 111.566 -170.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.831 ' HB2' ' HD3' ' A' ' 124' ' ' ARG . 48.8 mmtt -168.22 148.48 4.81 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.231 -177.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.523 HG22 ' OE2' ' A' ' 121' ' ' GLU . 73.2 p -64.47 173.34 2.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.481 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -60.24 -45.9 91.64 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -61.68 -48.9 78.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.722 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.723 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 4.7 mm-40 -60.59 -40.86 93.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.478 179.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.595 ' HA ' ' HD2' ' A' ' 124' ' ' ARG . 70.9 m -56.84 -45.58 82.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.307 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -76.91 -21.43 54.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.989 -176.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 34.7 mtm180 -73.08 -43.32 61.98 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.28 0.562 . . . . 0.0 110.149 173.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.49 -35.6 79.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.809 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 32' ' ' SER . 0.1 OUTLIER -85.56 -179.24 6.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.329 174.139 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 57.8 m 75.25 -43.91 0.52 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.784 0.434 . . . . 0.0 112.06 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.95 -21.06 60.79 Favored Glycine 0 C--O 1.227 -0.3 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.032 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.7 ptp -100.16 8.25 43.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.017 0.437 . . . . 0.0 110.636 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.82 29.97 53.32 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.343 -178.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.86 -178.8 4.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.545 0.212 . . . . 0.0 110.918 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.526 ' HB3' HG13 ' A' ' 76' ' ' VAL . 4.7 m-70 -143.12 168.2 20.31 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -57.42 157.45 6.66 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 111.62 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.63 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.6 tpt -52.92 99.4 0.02 OUTLIER 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.505 -176.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.456 ' H ' ' HG2' ' A' ' 127' ' ' LYS . 7.4 p -97.15 90.44 5.14 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.314 170.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.439 HG12 ' HE3' ' A' ' 39' ' ' MET . 42.5 mt -55.65 106.08 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.862 -178.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m -70.78 -51.47 26.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.596 -177.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.6 p -130.12 161.38 31.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.38 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.499 ' CD ' HH21 ' A' ' 84' ' ' ARG . 6.1 pt-20 -66.69 -27.94 68.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.986 0.422 . . . . 0.0 110.293 176.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.02 -36.78 84.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.164 174.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.56 -45.71 91.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.168 176.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.438 ' O ' HG21 ' A' ' 51' ' ' ILE . 55.1 tt0 -56.95 -53.88 52.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.05 175.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -58.87 -24.14 61.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.161 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -81.99 -52.08 7.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.531 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -66.92 -30.54 49.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.768 0.318 . . . . 0.0 111.619 -172.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.695 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.3 pt -73.16 -1.41 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.996 0.426 . . . . 0.0 111.746 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -83.58 -26.25 30.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.942 175.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -99.13 -23.78 15.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.484 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 83.6 mt -63.95 135.6 56.64 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.503 ' HB3' HD22 ' A' ' 58' ' ' LEU . 12.0 t70 -71.47 124.51 24.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.605 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 81.8 mtt180 -79.05 20.21 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -168.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.862 ' HG2' HD21 ' A' ' 58' ' ' LEU . 2.7 ptp180 -116.18 -15.71 11.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.721 0.296 . . . . 0.0 110.356 174.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.862 HD21 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -97.41 172.64 7.63 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.387 0.613 . . . . 0.0 111.439 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -128.28 117.95 22.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.061 176.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.497 ' HB3' HG13 ' A' ' 125' ' ' ILE . 78.2 m-85 -101.59 127.54 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.315 -171.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.648 ' HA ' HG12 ' A' ' 103' ' ' VAL . 1.7 m-85 -62.04 145.01 54.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.154 0.502 . . . . 0.0 112.232 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.655 ' HB2' HG12 ' A' ' 102' ' ' VAL . 95.9 mt -112.61 168.61 9.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.679 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -74.44 3.8 38.56 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 115.18 0.832 . . . . 0.0 115.18 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.902 ' HB2' HG11 ' A' ' 102' ' ' VAL . 4.0 mm? -73.46 117.34 15.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 118.244 1.022 . . . . 0.0 110.903 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -120.23 122.64 41.36 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.331 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.535 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 29.9 t70 -141.78 90.69 2.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.852 0.834 . . . . 0.0 109.911 163.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.593 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -74.45 -71.04 0.36 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.621 -177.767 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -84.67 31.61 0.53 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.459 -170.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 49.73 69.93 0.55 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.219 0.533 . . . . 0.0 111.559 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -95.53 -12.79 25.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.12 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.45 -40.35 2.58 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.014 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -81.16 98.04 7.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.073 0.463 . . . . 0.0 110.751 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.569 ' HB3' HD11 ' A' ' 64' ' ' LEU . 58.6 m95 -59.82 128.04 34.93 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.993 175.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -121.09 129.75 53.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.23 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.702 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 55.6 m95 -81.61 108.14 14.94 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.388 178.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.526 HG13 ' HB3' ' A' ' 37' ' ' HIS . 48.0 t 45.77 -80.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.706 1.254 . . . . 0.0 114.117 172.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 75' ' ' TRP . 4.3 t70 -96.33 -82.5 0.39 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.919 -168.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.44 -19.21 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.702 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 70.1 m -62.69 118.71 44.11 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 120.936 0.398 . . . . 0.0 111.928 -170.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.5 Cg_exo -71.09 169.8 19.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.616 2.877 . . . . 0.0 112.555 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.2 151.24 47.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.345 0.593 . . . . 0.0 110.976 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.632 ' ND2' ' HB2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -119.4 127.08 26.65 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.125 -174.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.79 -30.3 34.04 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.859 2.373 . . . . 0.0 112.48 175.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.499 HH21 ' CD ' ' A' ' 44' ' ' GLU . 11.2 tpt180 -78.12 -49.81 13.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.564 0.221 . . . . 0.0 111.484 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.632 ' HB2' ' ND2' ' A' ' 82' ' ' ASN . 29.9 mtm180 -80.49 81.25 6.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.069 0.461 . . . . 0.0 110.431 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.502 HG13 ' CD1' ' A' ' 88' ' ' TRP . 95.9 t -138.26 103.75 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.558 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.448 ' HB2' ' CD1' ' A' ' 113' ' ' TRP . 50.7 m-85 -125.93 39.66 3.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.585 ' HB2' ' HE3' ' A' ' 90' ' ' LYS . 66.2 m95 -65.77 160.46 22.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.611 0.243 . . . . 0.0 111.461 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.676 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 77.3 m-70 -77.5 -27.77 51.95 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.126 -176.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.585 ' HE3' ' HB2' ' A' ' 88' ' ' TRP . 6.8 mmtp 81.79 -5.59 1.51 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 124.431 1.082 . . . . 0.0 110.14 -176.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.595 ' OD1' ' HB3' ' A' ' 89' ' ' HIS . 2.8 p-10 -113.97 25.77 10.88 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.723 174.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.513 ' OE2' ' HB2' ' A' ' 89' ' ' HIS . 1.6 mp0 -57.24 145.82 64.84 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.035 176.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -80.05 -163.14 0.21 Allowed 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.658 2.239 . . . . 0.0 112.093 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.08 114.85 2.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.662 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.505 ' HA ' ' OD2' ' A' ' 115' ' ' ASP . 12.5 m120 -65.9 130.0 41.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.85 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.0 t -78.79 126.16 30.34 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.123 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -0.27 54.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.253 0.549 . . . . 0.0 110.473 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -131.37 105.09 0.61 Allowed Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 175.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 42.3 mt-10 63.2 88.58 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.905 0.383 . . . . 0.0 111.28 -174.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.535 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 6.9 p30 -107.62 118.93 38.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.346 0.593 . . . . 0.0 109.45 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 63.9 m -135.93 144.34 45.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.867 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.902 HG11 ' HB2' ' A' ' 64' ' ' LEU . 12.1 p -100.43 146.74 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 120.987 0.422 . . . . 0.0 111.432 -175.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.648 HG12 ' HA ' ' A' ' 61' ' ' PHE . 22.6 m -129.85 156.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.763 175.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.569 ' HG ' HD22 ' A' ' 62' ' ' LEU . 31.8 mt -88.52 113.4 24.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 171.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -125.8 141.33 45.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.397 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.515 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 61.3 t80 -79.92 103.84 10.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.151 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.676 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 26.1 t-20 -149.19 135.47 19.21 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.445 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 91.4 mt-30 66.38 31.9 7.97 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -172.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.405 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 12.5 m-20 59.53 26.25 15.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.732 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -145.56 153.1 40.72 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.196 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.695 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 88.0 m95 -87.53 107.05 18.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.853 176.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.62 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . . . -129.32 167.31 17.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.944 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.513 ' HB3' HG21 ' A' ' 102' ' ' VAL . 25.2 m0 -74.74 129.16 37.21 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.268 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -127.18 139.63 52.81 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.505 ' OD2' ' HA ' ' A' ' 95' ' ' ASN . 19.1 t70 -89.19 125.24 34.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.737 0.303 . . . . 0.0 111.178 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -143.41 158.05 58.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.513 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 13.4 Cg_endo -58.28 138.11 84.12 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.517 2.145 . . . . 0.0 111.771 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.6 m -70.49 -18.76 62.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.714 0.292 . . . . 0.0 111.029 -178.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -86.1 16.07 4.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.294 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -100.07 126.63 46.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.523 ' OE2' HG22 ' A' ' 23' ' ' THR . 3.2 mm-40 -73.49 124.18 25.33 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -144.16 176.64 9.17 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.475 177.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.499 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 35.0 m -67.55 157.62 33.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.894 0.378 . . . . 0.0 110.7 -177.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.831 ' HD3' ' HB2' ' A' ' 22' ' ' LYS . 80.6 mtm-85 -124.18 153.15 41.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.999 0.428 . . . . 0.0 111.984 -169.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.63 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 58.9 mt -134.92 120.72 31.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 171.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 12.5 m -103.49 131.75 50.34 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.457 ' HB2' ' CE1' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -123.33 135.55 54.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.221 0.534 . . . . 0.0 110.006 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.544 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -128.62 140.17 37.68 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.562 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.77 166.88 3.37 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.617 2.212 . . . . 0.0 111.981 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -71.57 59.19 1.24 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.008 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 77.4 p -71.6 -22.44 61.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.069 0.461 . . . . 0.0 110.349 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.8 m -71.93 -14.57 61.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.061 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 mp -80.06 -32.35 39.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -31.24 20.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.27 41.6 1.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.52 175.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -44.6 79.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.028 -173.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -72.61 -27.21 62.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.316 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.05 -48.3 74.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -71.53 -23.26 61.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.282 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -67.97 -33.09 73.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 0.0 110.243 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -87.93 -6.47 58.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.435 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.103 -175.829 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.485 HG12 ' CG2' ' A' ' 132' ' ' THR . 9.8 p -140.7 142.0 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.801 0.334 . . . . 0.0 110.307 177.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.0 m -139.2 162.37 52.38 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -52.82 142.07 52.99 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.063 1.842 . . . . 0.0 111.131 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.3 mt -73.79 80.47 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -173.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 176.68 -51.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.214 -1.357 . . . . 0.0 108.206 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -42.23 123.74 2.57 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.295 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -71.74 107.21 4.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 128.31 33.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.235 -176.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.463 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 83.8 t80 -139.25 102.11 4.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.644 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 60.67 -89.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.139 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 m -120.27 7.56 10.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.682 0.277 . . . . 0.0 111.282 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -130.35 158.51 39.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.856 0.36 . . . . 0.0 110.99 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.545 ' HB2' HG21 ' A' ' 128' ' ' ILE . 74.9 m -131.97 127.52 36.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.628 ' HH ' ' HG2' ' A' ' 46' ' ' GLU . 79.2 m-85 -115.41 129.06 56.45 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -170.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -121.34 114.87 31.6 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -88.48 123.36 1.54 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.326 2.684 . . . . 0.0 112.288 177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.451 HD23 ' CZ ' ' A' ' 124' ' ' ARG . 4.7 mp -109.82 139.39 44.95 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 p -105.31 14.98 28.07 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.373 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -85.83 162.29 18.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.0 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.457 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 20.0 m120 -85.12 118.24 24.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 1.003 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -149.03 141.73 24.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.772 178.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.54 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 62.8 p -72.63 174.55 7.39 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 174.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.436 ' CH2' HG21 ' A' ' 76' ' ' VAL . 31.2 t90 -62.42 -39.75 94.29 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.3 68.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.764 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 1.003 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 15.8 mm-40 -61.14 -37.32 82.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.456 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.403 ' HB2' HD21 ' A' ' 38' ' ' LEU . 68.8 m -60.05 -49.29 78.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.715 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.645 ' HG2' HD12 ' A' ' 38' ' ' LEU . 19.6 mm-40 -69.69 -22.02 63.45 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.407 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -67.93 -39.81 83.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.79 0.329 . . . . 0.0 110.918 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.28 -25.98 36.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.333 0.587 . . . . 0.0 109.567 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.421 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 88.4 m -85.65 -180.0 6.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.522 172.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 51.7 m 73.34 -44.92 0.6 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.928 0.491 . . . . 0.0 111.66 -178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.63 -22.99 66.59 Favored Glycine 0 C--O 1.227 -0.336 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.758 174.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.5 mtm -96.93 9.53 41.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.33 . . . . 0.0 110.696 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.64 27.75 68.68 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.998 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.85 173.83 10.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.475 0.178 . . . . 0.0 111.028 -175.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -140.2 168.66 19.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.645 HD12 ' HG2' ' A' ' 28' ' ' GLU . 10.8 mp -61.44 149.42 38.63 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.209 0.318 . . . . 0.0 110.37 173.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.55 ' HE2' HG12 ' A' ' 41' ' ' ILE . 12.4 tpt -50.71 103.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -175.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.439 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 11.8 p -94.45 94.85 8.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.077 172.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.55 HG12 ' HE2' ' A' ' 39' ' ' MET . 55.9 mt -66.99 95.8 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.237 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.9 m -92.75 -27.79 17.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.299 0.571 . . . . 0.0 109.811 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.411 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 53.0 p -125.2 147.87 48.87 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 122.238 1.018 . . . . 0.0 112.163 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.419 ' OE2' ' HD3' ' A' ' 85' ' ' ARG . 19.9 mt-10 -59.9 -31.45 69.83 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.629 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.446 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.4 -46.04 88.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.582 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.628 ' HG2' ' HH ' ' A' ' 15' ' ' TYR . 24.7 mt-10 -49.23 -55.29 13.05 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.583 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.36 -52.69 62.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.001 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -59.25 -34.77 72.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.446 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 59.9 m-85 -88.31 -37.7 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.601 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.6 tp -70.21 -30.75 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.283 -174.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.479 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 37.4 pt -71.29 -6.08 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.309 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -87.44 -21.54 25.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.025 176.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -94.81 -23.91 17.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.636 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.6 mt -74.28 139.84 44.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.543 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.408 ' HB3' HD22 ' A' ' 58' ' ' LEU . 12.0 t70 -75.36 133.81 41.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.552 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 81.5 mtt180 -80.22 16.71 1.19 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -169.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.92 ' HG2' HD21 ' A' ' 58' ' ' LEU . 2.9 ptp180 -119.59 -12.31 9.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.719 176.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.92 HD21 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -103.11 148.3 25.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.174 0.511 . . . . 0.0 111.607 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 p -100.5 116.91 33.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.541 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.632 ' HB3' HG13 ' A' ' 125' ' ' ILE . 95.4 m-85 -100.77 121.69 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.48 -174.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.835 ' HA ' HG13 ' A' ' 103' ' ' VAL . 14.1 m-85 -58.41 137.42 57.29 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.765 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.589 HD23 ' HG ' ' A' ' 104' ' ' LEU . 96.4 mt -105.61 157.11 17.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.942 176.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.463 ' O ' ' HE3' ' A' ' 75' ' ' TRP . . . -79.06 61.83 4.07 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.442 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.603 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 21.3 tp -129.64 134.22 47.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -135.33 134.91 40.33 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -170.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -133.61 88.96 2.53 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 164.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -81.84 134.05 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.89 0.376 . . . . 0.0 111.519 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 70.07 18.41 7.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.47 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.402 ' HB2' ' H ' ' A' ' 98' ' ' GLY . . . 62.23 87.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.314 0.578 . . . . 0.0 111.662 177.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.466 ' HE3' ' HB2' ' A' ' 70' ' ' LYS . 21.2 mtmt -112.38 -47.72 3.07 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.414 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.8 -19.3 47.59 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -94.9 83.85 4.06 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 121.227 0.537 . . . . 0.0 110.033 176.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.603 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 60.5 m95 -66.23 137.28 56.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.501 -178.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.428 ' O ' HD13 ' A' ' 64' ' ' LEU . 63.7 mtt180 -125.65 166.11 17.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.53 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 96.7 m95 -81.56 176.56 9.56 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.719 -0.793 . . . . 0.0 109.307 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.436 HG21 ' CH2' ' A' ' 24' ' ' TRP . 13.7 p -63.07 -34.4 66.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.854 0.359 . . . . 0.0 111.38 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -107.24 -168.78 1.44 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 177.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -77.6 73.72 4.17 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.42 0.629 . . . . 0.0 110.161 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 8.1 m -131.15 129.22 22.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.222 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 19.3 Cg_exo -68.66 144.91 61.83 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.237 2.625 . . . . 0.0 112.271 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -69.43 143.43 53.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.17 -176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 25.3 m-80 -77.55 110.39 12.55 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.704 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.94 -50.37 0.84 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.984 2.456 . . . . 0.0 112.776 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -82.71 -0.88 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 111.507 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.538 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 29.8 mtm180 -129.55 62.85 1.53 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 p -85.31 -32.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.261 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 66.7 -70.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 174.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 76.8 m95 53.49 -158.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.746 -167.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.581 ' CD2' ' HB1' ' A' ' 112' ' ' ALA . 10.4 t-80 -99.69 -23.8 14.91 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.886 0.374 . . . . 0.0 110.952 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.588 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 21.4 ttpp 171.11 -70.9 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.4 p30 -140.38 11.75 2.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.652 166.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.588 ' OE1' ' HB3' ' A' ' 90' ' ' LYS . 1.7 mp0 -79.36 104.85 2.55 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.155 175.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 88.1 Cg_endo -101.22 -151.9 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 123.72 2.947 . . . . 0.0 113.347 -172.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.8 136.29 58.03 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.315 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -134.67 -37.91 0.82 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.946 0.403 . . . . 0.0 110.965 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.403 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 23.3 t -85.36 152.14 23.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.138 -178.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -126.79 134.13 50.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.815 0.34 . . . . 0.0 110.24 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' A' ' 69' ' ' ALA . . . 91.22 -63.27 2.77 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.552 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 40.8 mt-10 -113.29 74.69 0.88 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.804 0.335 . . . . 0.0 110.114 172.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.403 ' HB3' ' O ' ' A' ' 96' ' ' SER . 1.7 p-10 -106.32 125.19 50.7 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.414 0.626 . . . . 0.0 110.29 177.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 2.2 p -157.66 136.57 11.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.964 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 30.1 m -88.67 147.7 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.408 0.623 . . . . 0.0 112.155 -173.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.835 HG13 ' HA ' ' A' ' 61' ' ' PHE . 25.2 m -124.5 158.62 31.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.14 174.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.589 ' HG ' HD23 ' A' ' 62' ' ' LEU . 31.7 mt -84.0 115.64 22.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.5 p -125.87 141.49 45.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.688 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.552 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 63.4 t80 -91.19 97.5 11.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.4 176.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.406 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 47.7 t-20 -141.38 132.93 26.97 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 66.18 31.85 8.42 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 123.838 0.712 . . . . 0.0 109.32 -171.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.464 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 15.2 m-20 60.09 25.06 14.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 114.55 -1.205 . . . . 0.0 112.414 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.46 ' NZ ' ' HB2' ' A' ' 90' ' ' LYS . 59.3 pttt -132.97 141.58 48.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 0.0 111.018 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.479 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 83.2 m95 -88.37 110.77 21.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.762 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.581 ' HB1' ' CD2' ' A' ' 89' ' ' HIS . . . -148.47 170.84 17.14 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.089 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -73.91 134.29 43.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.757 -175.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -134.01 123.93 25.4 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.08 131.68 38.5 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 19.4 m -140.75 158.89 64.46 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.337 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.48 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 16.2 Cg_endo -59.22 128.69 28.45 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.302 2.001 . . . . 0.0 111.138 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 99' ' ' GLU . 83.6 m -65.84 -17.34 64.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -177.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -82.49 -2.29 52.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.771 0.319 . . . . 0.0 111.263 177.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -83.7 115.45 22.19 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.522 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 1.4 mt-10 -72.34 110.64 6.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.452 0.644 . . . . 0.0 110.671 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -130.44 -172.05 2.7 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.511 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 33.1 m -78.25 169.57 18.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.451 ' CZ ' HD23 ' A' ' 18' ' ' LEU . 11.9 ptt180 -151.04 150.24 30.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.098 0.475 . . . . 0.0 111.91 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.632 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.1 mt -115.24 121.37 67.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.94 121.46 44.82 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 40' ' ' THR . 22.3 ptmt -115.41 127.36 55.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.985 0.422 . . . . 0.0 111.048 -176.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.545 HG21 ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -103.98 134.18 19.85 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.24 167.47 25.79 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.076 1.85 . . . . 0.0 110.938 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -68.26 60.86 0.41 Allowed Glycine 0 CA--C 1.521 0.442 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.131 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -76.63 10.37 2.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.198 0.523 . . . . 0.0 111.304 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.485 ' CG2' HG12 ' A' ' 2' ' ' VAL . 1.9 m -67.28 -18.58 65.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.583 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.03 -34.48 66.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.182 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -77.42 -38.3 49.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 0.0 109.337 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -85.46 31.22 0.59 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.981 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 12.3 pt-20 -60.12 -35.21 74.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.715 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.402 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 76.8 m-20 -73.31 -28.64 62.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.548 -177.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -68.17 -20.34 64.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.46 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -71.71 -38.58 70.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -73.91 -40.27 63.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.241 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 44.4 m . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.57 -179.269 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.433 ' HE1' ' HA3' ' A' ' 130' ' ' GLY . 24.0 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.692 HG13 HG22 ' A' ' 132' ' ' THR . 2.4 p -69.45 120.05 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.54 0.686 . . . . 0.0 110.877 -179.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.607 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 71.3 m -144.72 -178.36 0.78 Allowed Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.07 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.607 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 95.1 Cg_exo -46.98 147.68 4.74 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 121.818 1.679 . . . . 0.0 111.851 170.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tp -59.38 146.86 8.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.945 -172.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 77.81 -33.79 0.18 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.51 1.124 . . . . 0.0 112.023 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.509 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 24.1 m95 -47.73 118.6 2.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.817 0.341 . . . . 0.0 110.124 175.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.3 mmt-85 -71.47 113.45 8.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.481 -172.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.52 124.13 31.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.774 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.428 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 33.0 t80 -121.44 104.33 9.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 58.89 -101.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.435 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 t -96.91 -36.16 10.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.346 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -80.42 169.12 18.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.562 -173.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.96 136.33 26.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.366 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.428 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 24.9 m-85 -121.71 131.86 54.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.251 -169.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -111.67 115.26 51.55 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.198 176.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -89.09 124.85 1.5 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 123.107 2.538 . . . . 0.0 111.574 174.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.496 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -138.01 143.9 40.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.402 0.62 . . . . 0.0 111.272 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 73.9 p -110.27 18.77 19.56 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.798 -170.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -78.58 130.51 36.02 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.423 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.61 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 4.8 m-20 -63.48 100.52 0.26 Allowed 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.921 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.61 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 14.8 mmmm -133.63 143.75 48.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.614 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.4 p -65.79 163.85 15.9 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 174.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 60.0 t90 -57.76 -39.35 77.2 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.12 -51.67 68.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.892 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.542 ' HA ' ' HB2' ' A' ' 29' ' ' ARG . 14.5 mm-40 -70.57 -26.92 63.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.239 -177.141 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 53.1 m -58.0 -50.39 73.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.763 0.316 . . . . 0.0 110.33 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -70.81 -25.89 63.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.658 178.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -71.1 -51.43 25.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.938 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.41 ' HB3' HH12 ' A' ' 124' ' ' ARG . 3.7 t-20 -74.94 -30.67 61.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.1 0.476 . . . . 0.0 110.579 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.5 m -84.51 179.42 7.41 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 171.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 17.2 m 80.04 -45.11 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.532 0.733 . . . . 0.0 109.966 -174.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.67 -25.7 70.53 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.669 171.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.554 ' HG3' ' H ' ' A' ' 36' ' ' ALA . 21.7 ptp -88.7 1.79 54.49 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 110.573 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.44 -13.11 59.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.217 -176.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.554 ' H ' ' HG3' ' A' ' 34' ' ' MET . . . -95.43 141.13 29.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.89 -0.182 . . . . 0.0 110.512 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.552 ' CD2' HG11 ' A' ' 76' ' ' VAL . 13.5 t60 -118.97 158.14 26.34 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB2' HG21 ' A' ' 76' ' ' VAL . 5.9 mp -51.71 139.03 22.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -174.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.661 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.0 tpt -40.02 98.68 0.01 OUTLIER 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.436 -1.256 . . . . 0.0 113.448 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.491 HG22 ' OD2' ' A' ' 77' ' ' ASP . 6.4 p -94.79 91.84 6.67 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.453 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.623 HG12 ' HE3' ' A' ' 39' ' ' MET . 59.9 mt -59.4 100.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.279 -179.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -85.64 -34.4 21.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.032 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.557 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 35.1 p -130.23 151.61 50.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.379 0.609 . . . . 0.0 111.374 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -65.86 -35.51 80.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.851 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.432 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.3 -41.51 98.57 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 120.914 0.387 . . . . 0.0 110.357 175.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.557 ' HB3' ' O ' ' A' ' 43' ' ' THR . 66.4 tt0 -52.34 -51.76 57.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.611 175.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.83 -46.05 90.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.66 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -62.39 -28.36 69.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.116 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.533 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 15.9 m-85 -85.32 -31.87 22.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.56 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.8 tp -78.36 -32.69 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.029 -0.668 . . . . 0.0 111.384 -176.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.2 pt -65.28 -20.47 27.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.5 pt20 -87.79 -11.36 48.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.097 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -92.48 -26.34 18.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.049 0.452 . . . . 0.0 110.03 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 68.0 mt -77.05 159.94 29.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.982 -176.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -70.61 137.75 50.23 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.826 174.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -90.23 38.82 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.168 0.509 . . . . 0.0 111.698 -171.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -142.15 -46.83 0.35 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.53 172.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.67 163.49 7.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.797 0.808 . . . . 0.0 112.737 -171.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.583 ' HB3' ' CG1' ' A' ' 103' ' ' VAL . 1.4 m -108.17 129.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.94 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.506 ' N ' HG22 ' A' ' 103' ' ' VAL . 97.4 m-85 -117.38 120.15 37.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.517 0.198 . . . . 0.0 111.425 -175.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.94 130.15 42.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.084 0.468 . . . . 0.0 111.175 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.709 HD12 ' HB2' ' A' ' 104' ' ' LEU . 80.1 mt -111.63 175.93 5.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.337 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.73 39.44 2.71 Favored Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.69 -175.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.707 ' HB2' HG23 ' A' ' 102' ' ' VAL . 3.5 mm? -100.18 114.32 27.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.412 ' HD3' ' NH2' ' A' ' 74' ' ' ARG . 7.9 ttt85 -120.41 114.8 22.35 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -168.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -127.97 105.68 8.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 166.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -46.81 -78.24 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.902 -1.045 . . . . 0.0 113.265 -175.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -127.8 48.06 2.31 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.269 -170.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.35 70.87 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.595 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -87.57 -15.53 37.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.818 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.83 -45.41 3.47 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -175.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.21 92.13 6.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.692 0.758 . . . . 0.0 110.086 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -69.69 160.83 30.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.375 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.412 ' NH2' ' HD3' ' A' ' 65' ' ' ARG . 16.5 ptt180 -154.1 171.8 18.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.298 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -84.06 -176.18 6.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.976 0.417 . . . . 0.0 110.197 174.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.552 HG11 ' CD2' ' A' ' 37' ' ' HIS . 13.3 p -82.29 1.29 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.215 0.531 . . . . 0.0 111.486 -171.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.491 ' OD2' HG22 ' A' ' 40' ' ' THR . 1.6 p30 -123.89 -104.74 0.36 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.089 176.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -121.16 -23.59 5.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.435 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.1 m -54.46 123.02 41.6 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.634 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 27.3 Cg_exo -65.18 149.06 89.26 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.135 2.556 . . . . 0.0 111.988 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.82 136.92 57.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.838 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -87.81 112.15 47.01 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.88 7.4 4.63 Favored 'Trans proline' 0 CA--C 1.53 0.296 0 C-N-CA 122.646 2.231 . . . . 0.0 113.705 -174.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -119.27 -27.12 5.71 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.418 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -106.83 34.46 3.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.401 ' O ' HG11 ' A' ' 86' ' ' VAL . 6.2 p -80.42 95.76 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.846 0.832 . . . . 0.0 109.811 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -81.71 72.82 8.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.381 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -69.78 152.39 44.66 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.563 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 11.6 t-80 -66.07 -42.53 89.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.901 -171.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -177.82 -59.8 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.33 0.586 . . . . 0.0 109.98 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.533 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 1.0 OUTLIER -135.08 0.1 2.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.808 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -95.05 105.48 19.64 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.474 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.533 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 86.6 Cg_endo -95.82 -154.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 123.369 2.713 . . . . 0.0 111.512 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.96 146.36 33.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.56 -34.66 0.24 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.855 -171.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.58 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 67.2 m -65.27 97.89 0.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 111.583 -176.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -74.16 83.65 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.82 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.04 97.87 1.01 Allowed Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -174.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 33.1 mt-10 59.9 74.81 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.128 0.49 . . . . 0.0 110.858 -171.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.58 ' HB3' ' O ' ' A' ' 96' ' ' SER . 6.0 p-10 -100.58 101.75 12.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.573 0.701 . . . . 0.0 110.556 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 67.5 m -117.66 156.27 28.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.831 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 23.0 m -103.25 155.79 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.255 0.55 . . . . 0.0 110.819 177.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.688 ' O ' ' HA ' ' A' ' 113' ' ' TRP . 0.4 OUTLIER -123.03 143.98 34.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.533 176.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.709 ' HB2' HD12 ' A' ' 62' ' ' LEU . 17.8 tp -85.49 103.54 14.46 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 171.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.473 HG11 ' OD1' ' A' ' 114' ' ' ASN . 10.0 p -128.33 139.2 52.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.176 0.512 . . . . 0.0 111.785 -172.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.569 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 11.6 t80 -88.37 104.49 16.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -146.71 142.02 27.39 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.573 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 39.6 mt-30 53.46 65.69 1.45 Allowed 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.638 0.586 . . . . 0.0 110.342 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.1 p30 58.76 4.35 0.38 Allowed 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 173.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 108' ' ' GLN . 9.4 pttm -155.56 153.56 30.35 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.569 ' NE1' ' HD2' ' A' ' 106' ' ' TYR . 81.0 m95 -84.07 140.54 31.76 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.019 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.563 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -179.27 -179.4 0.55 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.65 0.594 . . . . 0.0 109.907 173.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 39.4 m0 -88.48 139.33 30.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.728 0.299 . . . . 0.0 111.03 -177.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.633 ' C ' HD21 ' A' ' 114' ' ' ASN . 0.1 OUTLIER -123.41 162.19 23.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.04 171.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.35 124.69 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.254 0.346 . . . . 0.0 110.928 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -147.77 141.89 16.1 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.204 175.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.574 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 10.0 Cg_endo -55.86 136.02 72.49 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.476 2.117 . . . . 0.0 111.395 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.419 ' HB2' ' OE1' ' A' ' 99' ' ' GLU . 15.0 m -67.15 -17.43 64.85 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.883 0.373 . . . . 0.0 110.665 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.32 7.27 33.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.614 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.8 t80 -88.98 143.76 26.63 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.75 135.7 35.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.873 0.368 . . . . 0.0 110.947 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.3 -168.8 1.96 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.543 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.403 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 20.2 m -78.59 169.44 18.24 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.468 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 13.0 ptt180 -147.25 162.91 37.95 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -172.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.661 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 8.3 mm -126.19 123.63 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.249 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 93.0 m -123.21 127.65 48.91 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.996 0.427 . . . . 0.0 110.293 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.471 ' HD3' ' H ' ' A' ' 40' ' ' THR . 21.6 ptmt -116.29 140.14 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.871 -175.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.443 HD12 ' HG1' ' A' ' 131' ' ' THR . 16.0 tt -125.96 145.29 51.49 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.211 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.06 167.33 14.43 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.514 2.143 . . . . 0.0 111.444 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.433 ' HA3' ' HE1' ' A' ' 1' ' ' MET . . . -70.32 74.46 0.54 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.757 175.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.443 ' HG1' HD12 ' A' ' 128' ' ' ILE . 25.8 p -83.19 19.51 1.45 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.506 0.323 . . . . 0.0 111.864 -175.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.692 HG22 HG13 ' A' ' 2' ' ' VAL . 14.5 t -60.15 -24.94 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.451 -178.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.6 mt -82.1 -23.83 35.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -89.47 -49.51 6.65 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.341 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.52 33.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.67 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.646 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -59.76 -64.21 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -175.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.646 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 6.2 p30 -84.3 -20.29 32.36 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.66 -45.52 89.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.566 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -72.69 -21.56 61.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.38 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -73.31 -23.42 60.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.357 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 73.5 mt-30 -86.07 -6.8 58.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 177.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.01 -177.206 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.808 ' HG3' ' HA3' ' A' ' 130' ' ' GLY . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -164.53 131.91 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.923 0.392 . . . . 0.0 110.076 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.1 m -141.09 166.56 21.7 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -177.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_exo -51.9 154.67 9.56 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.567 2.178 . . . . 0.0 112.489 176.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.8 tp -70.2 -14.88 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.817 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.59 -31.74 68.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.987 176.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.409 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 24.1 m95 -86.5 160.67 18.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.704 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.3 mmt-85 -111.8 122.89 49.02 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.112 177.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.37 124.29 42.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.121 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.438 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 82.9 t80 -121.8 103.27 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.837 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 65.6 -73.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.1 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.564 ' HA ' ' HG2' ' A' ' 1' ' ' MET . 18.3 m -139.32 5.38 2.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -123.95 157.88 33.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.788 0.327 . . . . 0.0 111.003 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.8 m -122.87 128.0 49.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.681 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.438 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 3.7 m-85 -119.35 138.15 53.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.18 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.409 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 62.1 t80 -139.23 115.68 8.51 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -88.01 138.11 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.839 2.36 . . . . 0.0 112.293 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.45 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.8 mp -124.43 139.6 53.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.974 0.416 . . . . 0.0 110.143 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.5 p -110.31 35.19 3.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.871 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.86 -27.23 40.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.3 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.514 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 46.6 m-80 70.08 116.19 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.62 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.629 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 13.3 mmmm -159.37 150.44 19.83 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.663 HG22 ' OE2' ' A' ' 121' ' ' GLU . 16.6 p -60.38 166.8 2.83 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 170.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.466 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 63.3 t90 -59.32 -42.26 90.98 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.41 -51.34 69.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.74 176.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.629 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 32.4 mm-40 -68.14 -31.22 70.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.4 ' HB3' HD21 ' A' ' 38' ' ' LEU . 54.2 m -65.27 -40.74 94.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.822 0.344 . . . . 0.0 110.236 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -71.31 -34.02 70.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.761 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 98.0 mtt180 -69.68 -40.15 76.54 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.845 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -76.16 -25.82 55.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.39 0.614 . . . . 0.0 109.769 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 32' ' ' SER . 67.0 m -85.68 -179.45 6.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 167.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 29.1 m 79.46 -43.68 0.3 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.064 0.546 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.88 -25.18 67.48 Favored Glycine 0 C--O 1.227 -0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.807 173.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 71.5 mtm -94.61 7.1 46.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.871 0.367 . . . . 0.0 110.392 177.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.6 -6.68 64.26 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.152 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.499 ' CB ' ' HB ' ' A' ' 128' ' ' ILE . . . -95.39 162.83 13.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.522 0.201 . . . . 0.0 110.69 -177.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -133.4 168.57 18.37 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 38' ' ' LEU . 76.1 mt -61.39 146.28 48.8 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.931 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.616 ' HE3' HG12 ' A' ' 41' ' ' ILE . 12.6 tpt -44.88 110.79 0.25 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.161 0.913 . . . . 0.0 113.178 -172.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.483 HG22 ' HB3' ' A' ' 75' ' ' TRP . 23.7 p -101.8 105.76 16.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.892 173.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.616 HG12 ' HE3' ' A' ' 39' ' ' MET . 45.4 mt -79.2 119.42 28.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.091 0.472 . . . . 0.0 110.538 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.5 p -106.58 -36.62 6.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.261 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 70.5 p -127.71 152.97 47.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 112.032 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.93 -33.05 74.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.53 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.43 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -68.29 -44.45 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.622 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -52.54 -48.71 65.94 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.885 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -59.96 -48.94 79.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.978 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -62.19 -23.09 66.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.238 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.43 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 30.5 m-85 -88.33 -39.07 14.64 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 177.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -71.4 -30.49 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.305 -176.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.1 pt -71.62 -3.96 4.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.85 0.357 . . . . 0.0 111.312 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -87.25 -21.74 25.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.852 175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 -19.77 18.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.151 178.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 79.1 mt -79.06 134.05 36.77 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.966 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.25 128.29 35.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.964 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.1 mtt180 -72.39 53.78 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.717 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -160.33 -29.95 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.317 177.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.717 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -86.9 158.39 19.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.29 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.7 m -109.47 118.89 37.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.527 176.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.745 ' HB3' HG13 ' A' ' 125' ' ' ILE . 91.4 m-85 -105.23 120.91 42.71 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.757 0.281 . . . . 0.0 111.757 -173.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.728 ' HA ' HG11 ' A' ' 103' ' ' VAL . 13.8 m-85 -58.6 137.87 57.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.104 0.478 . . . . 0.0 112.048 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.666 HD23 ' HG ' ' A' ' 104' ' ' LEU . 91.1 mt -103.8 166.02 10.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.707 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -87.07 34.74 3.53 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.898 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.6 tp -92.11 114.74 27.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.517 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 21.7 ttm-85 -104.19 126.99 51.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -168.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.483 ' O ' ' HA ' ' A' ' 99' ' ' GLU . 16.2 t70 -142.24 101.05 3.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.896 168.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.517 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 0.4 OUTLIER -102.18 137.08 40.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.68 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.67 7.17 6.12 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.011 177.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.981 ' HB3' ' HA2' ' A' ' 98' ' ' GLY . . . 69.07 95.94 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.297 0.57 . . . . 0.0 111.448 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -118.68 -35.73 3.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.78 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.62 -4.28 79.27 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.757 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -93.11 100.91 13.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.391 0.615 . . . . 0.0 110.363 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -71.73 112.09 7.54 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.151 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -135.71 141.77 44.95 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.615 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 93.9 m95 -78.86 156.92 28.46 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.891 176.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 p -56.9 -45.18 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.36 -174.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 7.5 t70 -94.03 -158.06 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 6.4 tt0 -81.83 67.8 7.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.187 0.517 . . . . 0.0 110.118 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.615 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 13.1 m -130.29 113.05 16.96 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-O 121.305 0.574 . . . . 0.0 110.099 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -69.04 154.43 70.59 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.443 2.762 . . . . 0.0 112.025 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.495 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 85.0 t80 -78.16 133.06 37.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.432 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 27.9 m-80 -102.33 104.22 35.94 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.766 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -64.79 -33.62 52.93 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.838 2.359 . . . . 0.0 112.289 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -80.07 -18.31 50.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.057 0.456 . . . . 0.0 110.738 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.432 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 82.8 mtt180 -119.28 37.66 4.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.092 0.472 . . . . 0.0 110.995 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.521 HG21 ' CZ3' ' A' ' 113' ' ' TRP . 14.8 p -93.56 127.93 45.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.432 174.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -110.37 72.14 0.78 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.929 0.395 . . . . 0.0 111.117 -173.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -71.4 174.8 6.07 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.428 0.632 . . . . 0.0 111.423 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.592 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 24.9 m-70 -88.0 -168.51 2.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 171.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -126.26 -23.56 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.602 -0.439 . . . . 0.0 112.015 -174.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -135.68 6.21 3.19 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.592 ' OE1' ' HB3' ' A' ' 89' ' ' HIS . 4.6 mp0 -118.21 98.75 51.62 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.983 -173.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -97.96 -164.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.558 2.839 . . . . 0.0 113.396 -176.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -49.06 130.69 18.91 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.78 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -107.35 3.49 25.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.749 173.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.638 ' HB2' ' HD3' ' A' ' 117' ' ' PRO . 34.3 t -165.52 149.45 8.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -121.91 83.07 2.04 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.981 ' HA2' ' HB3' ' A' ' 69' ' ' ALA . . . 144.2 114.53 0.96 Allowed Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.395 -173.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.483 ' HA ' ' O ' ' A' ' 66' ' ' ASP . 43.7 mt-10 54.55 67.12 1.06 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.21 0.528 . . . . 0.0 109.636 -171.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -102.61 109.0 20.48 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.286 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.2 p -123.24 137.53 54.85 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.968 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.619 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 32.0 m -86.55 148.59 4.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.345 0.593 . . . . 0.0 111.71 -175.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.728 HG11 ' HA ' ' A' ' 61' ' ' PHE . 33.4 m -122.06 153.66 26.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.401 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.666 ' HG ' HD23 ' A' ' 62' ' ' LEU . 19.1 mt -83.52 106.45 15.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.526 HG13 ' HE2' ' A' ' 89' ' ' HIS . 7.3 p -125.79 146.2 31.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.442 -177.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.608 ' CE1' ' HA ' ' A' ' 109' ' ' ASP . 86.2 t80 -87.93 109.08 19.53 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.79 -177.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.525 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 19.0 m120 -140.77 127.01 19.71 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 63.21 37.85 10.93 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.42 0.629 . . . . 0.0 109.896 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.608 ' HA ' ' CE1' ' A' ' 106' ' ' TYR . 9.3 t70 73.68 -17.47 0.44 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.117 -1.402 . . . . 0.0 111.959 178.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.631 ' HZ2' ' HB3' ' A' ' 112' ' ' ALA . 6.2 pttp -102.22 142.09 34.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.494 0.664 . . . . 0.0 111.029 -175.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -84.35 135.6 34.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.421 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.631 ' HB3' ' HZ2' ' A' ' 110' ' ' LYS . . . -157.12 165.93 34.65 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.228 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.619 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 20.3 m0 -76.52 123.77 26.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.446 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.467 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 4.6 t30 -111.74 123.62 50.63 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -67.71 123.29 20.09 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.515 0.509 . . . . 0.0 109.871 177.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.481 ' CG2' ' HD2' ' A' ' 117' ' ' PRO . 4.1 p -144.47 146.56 33.13 Favored Pre-proline 0 C--N 1.32 -0.709 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.638 ' HD3' ' HB2' ' A' ' 96' ' ' SER . 11.6 Cg_endo -57.12 133.29 56.73 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.932 1.754 . . . . 0.0 111.324 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 85.0 m -64.39 -9.36 17.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -96.68 22.64 7.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.03 0.443 . . . . 0.0 110.719 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.484 ' O ' ' HA ' ' A' ' 23' ' ' THR . 74.1 t80 -99.76 128.04 45.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.698 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.663 ' OE2' HG22 ' A' ' 23' ' ' THR . 45.1 mm-40 -73.67 123.22 23.65 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -152.05 178.99 8.87 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.1 m -72.96 168.77 18.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -148.19 150.27 33.45 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.998 0.428 . . . . 0.0 112.003 -170.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.745 HG13 ' HB3' ' A' ' 60' ' ' TYR . 54.6 mt -116.91 125.15 73.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.271 173.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.7 t -103.25 126.61 50.5 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -128.9 127.23 41.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.768 -171.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.499 ' HB ' ' CB ' ' A' ' 36' ' ' ALA . 11.8 tt -132.15 141.97 43.34 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.58 157.26 62.6 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 121.942 1.761 . . . . 0.0 110.864 171.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.808 ' HA3' ' HG3' ' A' ' 1' ' ' MET . . . -75.36 58.03 2.85 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.215 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.3 t -87.03 19.31 3.12 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.125 0.57 . . . . 0.0 110.914 -174.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -28.79 58.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.266 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.5 mt -70.18 -31.7 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.491 . . . . 0.0 110.619 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.01 -39.74 14.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.307 0.575 . . . . 0.0 110.121 177.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.519 ' HB3' ' HB3' ' A' ' 138' ' ' LEU . . . -89.83 38.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.728 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.2 -46.86 79.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.729 0.3 . . . . 0.0 111.576 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 57.1 t30 -75.22 -30.01 60.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.454 -177.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 135' ' ' ALA . 6.9 tt -64.64 -48.19 75.74 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -70.26 -20.66 63.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.274 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -75.2 -32.25 61.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.508 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 78.3 mm-40 -87.39 -6.4 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.93 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.998 -176.434 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.4 ' H1 ' ' HA3' ' A' ' 35' ' ' GLY . 62.5 mtt . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.8 m -113.8 170.57 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 169.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 7' ' ' TRP . 6.0 p -119.65 116.01 33.46 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-O 121.099 0.476 . . . . 0.0 111.209 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 3' ' ' CYS . 44.3 Cg_endo -68.4 171.13 13.43 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.135 2.557 . . . . 0.0 111.292 174.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 35.7 mt -70.44 70.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.539 0.685 . . . . 0.0 111.184 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -166.96 -42.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 37.3 m95 -62.41 119.31 8.86 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 164.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -72.43 109.22 5.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.915 0.388 . . . . 0.0 110.783 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.99 121.48 25.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.251 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.601 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 85.5 t80 -139.15 129.87 26.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.446 ' HG3' ' CD2' ' A' ' 10' ' ' PHE . 52.0 mt-30 66.03 -82.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.697 0.623 . . . . 0.0 110.345 -175.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -152.19 8.64 0.48 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.742 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.402 ' OD1' ' HA ' ' A' ' 129' ' ' PRO . 60.5 m-80 -116.98 166.64 11.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.405 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.731 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 4.1 m -118.03 127.49 53.86 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.601 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 35.7 m-85 -122.52 133.13 54.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.497 0.189 . . . . 0.0 111.034 -174.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.408 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 52.5 t80 -140.34 117.35 8.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.857 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.1 Cg_endo -84.22 137.43 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.376 2.717 . . . . 0.0 112.105 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.463 HD22 ' NH2' ' A' ' 124' ' ' ARG . 3.8 mp -129.44 140.01 51.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.1 p -101.65 21.94 13.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.947 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.52 149.18 50.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.498 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -83.27 97.67 9.0 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 170.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -143.79 145.91 32.71 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.068 0.461 . . . . 0.0 111.065 -172.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.0 p -80.78 173.78 12.27 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.708 173.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.472 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 9.6 t90 -65.25 -35.91 82.48 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -64.0 -48.9 74.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.832 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -62.93 -44.11 96.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.246 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.403 ' HB2' HD12 ' A' ' 38' ' ' LEU . 10.9 p -65.13 -33.1 75.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.647 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.481 ' HA ' HD23 ' A' ' 38' ' ' LEU . 27.2 tt0 -61.57 -37.82 85.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 174.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.587 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 15.6 mmm180 -84.49 -36.81 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.403 -176.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -74.0 -37.92 64.26 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.122 0.487 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 32' ' ' SER . 35.5 m -84.81 177.23 8.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 169.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.733 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 18.8 m 75.77 -48.48 0.6 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.497 0.319 . . . . 0.0 110.594 -175.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.88 -30.68 73.65 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 121.288 -0.482 . . . . 0.0 112.229 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 77.7 mtm -80.32 4.16 18.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.984 0.421 . . . . 0.0 110.788 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.4 ' HA3' ' H1 ' ' A' ' 1' ' ' MET . . . 74.72 51.76 7.76 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 -170.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.733 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -147.02 -175.49 4.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.086 -0.557 . . . . 0.0 109.91 -173.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -149.29 170.43 18.53 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 175.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 28' ' ' GLU . 4.2 mm? -63.59 157.6 23.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.837 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -61.55 96.41 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.394 0.616 . . . . 0.0 111.586 -177.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.35 98.34 8.72 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.466 176.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.593 HG12 ' HE1' ' A' ' 39' ' ' MET . 52.8 mt -64.6 115.51 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.669 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 -28.13 16.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.103 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.612 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 25.5 p -141.38 154.91 45.91 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.532 0.682 . . . . 0.0 111.652 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.41 -37.49 83.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.204 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.401 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -59.82 -41.44 91.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.115 0.484 . . . . 0.0 109.999 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.612 ' HB3' ' O ' ' A' ' 43' ' ' THR . 70.3 tt0 -51.5 -51.99 50.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.593 174.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -58.08 -50.4 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.068 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -56.8 -30.85 64.1 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.234 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.401 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 36.6 m-85 -88.53 -39.31 14.25 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.07 -28.56 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.377 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.478 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.9 pt -70.3 -8.8 11.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.963 0.411 . . . . 0.0 111.403 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.4 HE21 ' HA ' ' A' ' 49' ' ' PHE . 50.2 mt-30 -87.68 -18.21 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.308 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -93.03 -20.25 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.068 176.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 82.3 mt -81.84 130.27 35.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.994 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.533 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.3 t70 -64.5 136.61 57.23 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 172.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.474 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 84.9 mtt180 -86.99 15.97 5.44 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -169.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.611 ' HG2' HD22 ' A' ' 58' ' ' LEU . 9.8 ptp85 -113.62 -11.99 12.92 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.304 -0.559 . . . . 0.0 111.083 174.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.611 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.3 mm? -99.24 164.56 12.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.284 0.564 . . . . 0.0 111.717 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -120.63 114.4 21.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.254 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.631 ' HB3' HG13 ' A' ' 125' ' ' ILE . 47.7 m-85 -102.51 126.62 49.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.587 0.218 . . . . 0.0 111.587 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.774 ' HA ' HG12 ' A' ' 103' ' ' VAL . 33.2 m-85 -62.14 139.87 58.45 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.962 0.41 . . . . 0.0 111.707 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.47 HD22 ' HG ' ' A' ' 104' ' ' LEU . 73.5 mt -105.02 158.56 16.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.145 175.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -83.2 53.89 4.91 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 114.461 0.544 . . . . 0.0 114.461 -170.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.565 ' HA ' ' HA ' ' A' ' 75' ' ' TRP . 2.3 pt? -135.36 150.24 49.89 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -153.35 144.32 22.87 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.433 0.635 . . . . 0.0 111.401 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.787 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 30.7 t70 -107.98 93.57 4.61 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 162.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.56 ' CD ' ' HZ3' ' A' ' 70' ' ' LYS . 3.4 tm-20 -64.97 112.74 3.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.87 -167.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 52.99 34.8 17.77 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.642 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 66.79 92.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.617 0.723 . . . . 0.0 112.046 175.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HZ3' ' CD ' ' A' ' 67' ' ' GLU . 41.3 mttp -126.13 -13.52 6.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 177.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.01 19.73 79.78 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.099 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.79 93.74 4.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.477 0.656 . . . . 0.0 110.706 -178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -71.8 103.24 3.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.541 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -147.92 155.62 41.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.821 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.565 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 80.0 m95 -81.93 168.6 17.73 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 176.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.09 -34.22 67.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -116.09 79.23 1.28 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 70.79 -50.0 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.066 173.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.443 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 18.7 m -47.41 124.1 9.07 Favored Pre-proline 0 C--N 1.329 -0.322 0 C-N-CA 123.361 0.665 . . . . 0.0 112.548 -170.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.4 Cg_exo -71.63 153.55 59.8 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 123.168 2.579 . . . . 0.0 111.625 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.489 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 87.4 t80 -61.52 147.06 46.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.366 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.478 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 50.6 m-80 -98.8 100.04 8.9 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.844 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 74.0 Cg_endo -79.65 -24.95 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.355 2.037 . . . . 0.0 112.011 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -91.16 -7.79 50.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.134 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.478 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 78.4 mtm180 -134.59 44.97 2.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.12 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 p -95.28 131.55 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.143 0.497 . . . . 0.0 109.839 177.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -115.65 74.5 0.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -175.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -75.12 -179.52 4.42 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.672 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 90.9 m-70 -89.97 -70.41 0.67 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.405 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.591 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 1.6 tmtm? 166.96 -30.12 0.0 OUTLIER 'General case' 0 C--O 1.235 0.32 0 O-C-N 124.037 0.835 . . . . 0.0 110.028 -177.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.591 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 2.4 t30 -144.04 61.45 1.36 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.26 -174.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.455 ' OE2' ' HB2' ' A' ' 89' ' ' HIS . 3.0 mm-40 -63.9 144.5 98.06 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.759 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.22 -65.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.007 2.471 . . . . 0.0 113.032 -176.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -163.49 159.66 22.34 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.38 103.84 14.66 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 176.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.9 m -51.06 108.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.566 0.698 . . . . 0.0 111.893 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.474 ' H ' ' CD ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -79.74 19.82 0.64 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.395 -178.305 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -162.08 111.19 0.47 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.709 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 5.9 mm-40 55.75 83.93 0.09 Allowed 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.423 0.63 . . . . 0.0 110.848 -171.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.787 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 3.1 t-20 -101.09 124.79 47.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.205 -171.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.7 p -157.0 166.1 34.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.273 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.537 HG21 HD21 ' A' ' 64' ' ' LEU . 1.3 m -115.96 153.86 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.888 -176.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.774 HG12 ' HA ' ' A' ' 61' ' ' PHE . 23.1 m -124.88 153.47 31.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.132 177.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.47 ' HG ' HD22 ' A' ' 62' ' ' LEU . 23.4 mt -84.55 109.67 18.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 171.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.0 143.24 41.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.562 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -84.25 102.42 12.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.446 177.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.672 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 19.3 t-20 -147.47 136.73 22.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.668 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.468 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 25.3 mt-30 69.94 31.81 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.994 0.808 . . . . 0.0 109.092 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 t0 63.52 22.11 13.05 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.362 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.61 152.76 40.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.66 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.478 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -77.54 138.4 39.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.53 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . . . -166.99 165.62 15.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.621 0.248 . . . . 0.0 110.95 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -77.74 135.31 38.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.55 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -125.36 135.85 52.85 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -73.31 124.7 26.22 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 123.388 0.43 . . . . 0.0 110.393 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.1 m -143.52 156.42 60.17 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.893 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -67.5 132.18 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.237 1.958 . . . . 0.0 110.907 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.709 ' HB2' ' HB3' ' A' ' 99' ' ' GLU . 81.9 m -62.37 -21.56 65.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.932 0.396 . . . . 0.0 111.309 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -94.93 64.37 2.83 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.496 0.665 . . . . 0.0 110.099 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -140.65 139.91 34.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.21 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -78.3 110.83 13.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.143 0.497 . . . . 0.0 111.22 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.47 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -147.76 179.09 7.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.457 175.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 p -80.54 174.59 11.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.784 0.326 . . . . 0.0 110.402 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.463 ' NH2' HD22 ' A' ' 18' ' ' LEU . 19.1 ptt180 -144.96 156.35 43.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.039 0.447 . . . . 0.0 111.564 -171.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.837 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 30.6 mt -122.41 131.62 72.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.04 124.22 48.1 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 19.7 tptm -112.28 111.75 22.85 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.504 -172.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.731 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 38.1 mt -96.85 124.35 50.41 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.553 174.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 131' ' ' THR . 40.3 Cg_endo -69.07 168.74 19.78 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.673 2.249 . . . . 0.0 111.279 177.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.59 37.69 0.1 OUTLIER Glycine 0 CA--C 1.526 0.754 0 N-CA-C 114.497 0.559 . . . . 0.0 114.497 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 129' ' ' PRO . 7.2 t -77.54 -17.53 57.84 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.0 m -62.93 -30.45 71.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.941 173.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.45 -29.17 61.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.479 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -79.68 -29.2 40.74 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.569 0.699 . . . . 0.0 109.631 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.608 ' HB2' ' HB3' ' A' ' 138' ' ' LEU . . . -89.96 44.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.338 176.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.67 -55.02 34.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.898 -175.463 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.5 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 7.5 m-80 -71.84 -27.16 62.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.049 0.452 . . . . 0.0 110.221 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.608 ' HB3' ' HB2' ' A' ' 135' ' ' ALA . 3.1 tm? -60.35 -47.52 85.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.535 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -75.39 -28.12 59.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.571 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . 0.45 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 85.2 t80 -63.36 -25.76 68.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.1 mt-30 -79.24 -8.6 59.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.592 178.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.867 -177.567 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.563 ' HE2' ' HA ' ' A' ' 12' ' ' SER . 2.0 mpt? . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.0 t -85.57 118.17 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.484 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 73.6 m -144.18 172.38 5.57 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.777 -172.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.566 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 51.4 Cg_exo -53.71 160.88 4.98 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.473 2.115 . . . . 0.0 112.439 176.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.514 HD11 ' H ' ' A' ' 5' ' ' ILE . 3.5 mp -58.92 135.11 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.814 -174.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 81.4 -18.51 0.48 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.375 1.07 . . . . 0.0 112.383 173.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.566 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 28.4 m95 -58.97 121.11 10.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.459 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 5.2 mpt_? -72.96 103.28 3.71 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.371 -175.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.14 120.85 21.21 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.443 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -128.24 104.77 7.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 61.44 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.612 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.563 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 18.0 m -110.63 -37.27 5.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.562 -176.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -101.89 173.25 6.49 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.745 -170.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.555 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 58.0 m -135.57 131.28 35.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.474 ' CE2' ' HB3' ' A' ' 127' ' ' LYS . 69.6 m-85 -118.25 126.14 51.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.815 0.341 . . . . 0.0 111.809 -172.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.472 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 67.0 t80 -111.99 119.61 43.9 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.946 177.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.3 Cg_endo -85.65 134.23 4.64 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.2 2.6 . . . . 0.0 112.184 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 138.66 54.6 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.85 0.357 . . . . 0.0 110.179 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 p -88.68 -4.76 58.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.261 0.553 . . . . 0.0 109.916 174.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 t70 -56.0 139.06 47.81 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.356 178.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.433 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 13.6 m120 -92.82 105.35 17.5 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.644 ' HB2' ' HZ1' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -139.19 154.08 48.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.775 -178.443 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.49 ' OG1' ' HG2' ' A' ' 26' ' ' GLU . 57.4 p -80.11 168.59 18.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.408 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 23.4 t90 -59.92 -39.83 86.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.041 0.448 . . . . 0.0 110.41 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.12 -48.7 50.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.354 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HB2' ' HG3' ' A' ' 22' ' ' LYS . 12.0 mm-40 -69.38 -28.81 66.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.673 0.273 . . . . 0.0 110.821 -177.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.536 ' HB3' HD21 ' A' ' 38' ' ' LEU . 73.2 m -57.94 -45.68 86.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.985 173.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.483 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 6.6 mm-40 -74.78 -18.77 60.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 177.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -73.84 -35.31 64.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.802 0.334 . . . . 0.0 110.923 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.15 -38.91 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.525 0.679 . . . . 0.0 110.022 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.3 m -87.49 179.15 6.61 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.97 174.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.791 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 62.0 m 73.59 -43.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.482 0.313 . . . . 0.0 111.496 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.12 -22.94 65.57 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.907 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mtm -87.51 12.47 12.26 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.162 0.185 . . . . 0.0 110.768 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.448 ' O ' HG13 ' A' ' 128' ' ' ILE . . . 72.61 38.93 57.07 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -172.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.791 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -134.02 -174.27 3.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.949 -0.626 . . . . 0.0 110.512 -171.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.31 168.08 27.29 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 176.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' A' ' 27' ' ' SER . 41.2 mt -64.79 146.79 54.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.378 0.535 . . . . 0.0 110.799 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.733 ' HE3' HG12 ' A' ' 41' ' ' ILE . 23.5 ttt -59.05 126.13 26.43 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 121.451 0.643 . . . . 0.0 111.972 -176.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.504 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 33.4 p -118.72 106.96 13.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.717 173.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.733 HG12 ' HE3' ' A' ' 39' ' ' MET . 48.6 mt -58.5 104.23 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.733 -176.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.8 m -89.7 -31.36 17.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.789 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.457 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 27.3 p -137.42 152.35 49.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.531 0.682 . . . . 0.0 111.604 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.17 -43.41 98.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.688 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -60.59 -37.15 80.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.497 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.457 ' HB3' ' O ' ' A' ' 43' ' ' THR . 40.1 tt0 -55.05 -51.39 66.48 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.386 177.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.476 ' HA ' HG21 ' A' ' 50' ' ' ILE . 48.1 tt0 -60.03 -47.34 86.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.695 176.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -57.34 -35.26 69.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.889 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.656 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 35.8 m-85 -84.4 -29.2 26.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.4 tp -78.62 -31.1 15.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.047 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.408 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 32.5 pt -72.48 -4.38 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -176.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.656 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 2.7 pt20 -87.88 -20.42 26.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 175.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -94.38 -30.14 14.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 81.9 mt -71.09 144.19 50.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.559 -176.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.508 ' HB3' HD21 ' A' ' 58' ' ' LEU . 13.5 t70 -76.06 131.85 39.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.381 176.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.569 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 76.7 mtt180 -84.43 27.47 0.7 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -170.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.805 ' HG2' HD23 ' A' ' 58' ' ' LEU . 3.0 ptp180 -126.95 -13.78 5.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.699 0.285 . . . . 0.0 110.848 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.805 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -97.66 157.57 15.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.039 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 p -108.96 115.55 30.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.682 174.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.589 ' HB3' HG13 ' A' ' 125' ' ' ILE . 96.2 m-85 -99.55 123.86 44.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.587 ' HA ' HG11 ' A' ' 103' ' ' VAL . 8.2 m-85 -61.39 139.06 58.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.997 0.427 . . . . 0.0 111.824 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.5 mt -114.42 175.49 5.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.145 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.08 -2.37 90.43 Favored Glycine 0 CA--C 1.521 0.468 0 C-N-CA 120.903 -0.665 . . . . 0.0 114.407 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.467 ' HB2' HG22 ' A' ' 102' ' ' VAL . 15.0 mt -79.68 127.48 32.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.809 0.804 . . . . 0.0 110.742 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HG3' ' SG ' ' A' ' 101' ' ' CYS . 35.0 ttt180 -137.63 129.02 28.03 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -94.5 147.27 23.43 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 161.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.03 26.77 1.33 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.456 ' HB2' ' HZ2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -179.54 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.249 179.511 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.59 32.33 21.68 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -167.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.456 ' HZ2' ' HB2' ' A' ' 68' ' ' ASN . 2.9 ptpp? -85.26 -19.42 31.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.741 -173.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.32 5.71 59.96 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.397 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -86.58 82.93 7.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.441 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 98.7 m95 -69.34 105.88 2.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.362 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -126.43 146.0 50.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.729 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.543 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 76.5 m95 -84.91 139.56 31.76 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.47 -11.8 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.142 0.496 . . . . 0.0 111.689 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.48 ' HB3' HG21 ' A' ' 40' ' ' THR . 32.6 t70 -99.41 29.24 4.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.306 0.574 . . . . 0.0 109.989 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.36 -12.31 0.73 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.33 177.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.543 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.3 m -59.38 131.33 87.83 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.113 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.97 159.51 44.61 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.889 2.393 . . . . 0.0 112.044 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 52.6 t80 -71.29 139.0 49.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.559 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -90.46 114.76 62.27 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.109 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.511 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.8 Cg_exo -74.7 -12.32 22.17 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.115 2.543 . . . . 0.0 112.899 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -123.89 -43.99 2.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.881 0.372 . . . . 0.0 110.764 178.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -84.05 52.22 2.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 109.842 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.5 p -98.21 -33.56 4.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.567 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 68.44 -65.19 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.424 0.689 . . . . 0.0 112.67 172.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.416 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 39.7 m95 53.89 -169.06 0.06 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.534 ' HA ' ' HB2' ' A' ' 112' ' ' ALA . 1.5 t-80 -99.61 -18.12 17.48 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.896 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 1.7 tttm 83.56 -5.21 1.17 Allowed 'General case' 0 N--CA 1.472 0.652 0 O-C-N 124.336 1.022 . . . . 0.0 110.942 176.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -168.92 72.48 0.09 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.9 0.857 . . . . 0.0 109.998 176.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' A' ' 88' ' ' TRP . 0.4 OUTLIER -123.95 146.13 50.04 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.651 -177.423 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -96.62 -170.36 0.15 Allowed 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 123.059 2.506 . . . . 0.0 112.044 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -123.62 101.37 7.27 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -103.11 -30.8 10.5 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.405 0.622 . . . . 0.0 110.073 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.9 t -92.53 63.51 4.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.852 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.47 95.44 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.543 0.687 . . . . 0.0 110.761 177.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 149.15 -71.45 0.31 Allowed Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.506 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 29.8 mt-10 -116.54 81.82 1.69 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 172.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -91.16 99.78 12.73 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.255 0.55 . . . . 0.0 109.917 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.514 ' SG ' ' HG3' ' A' ' 65' ' ' ARG . 29.8 m -103.5 136.47 43.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.623 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 26.8 m -93.25 138.78 19.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.152 0.501 . . . . 0.0 110.961 -179.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.587 HG11 ' HA ' ' A' ' 61' ' ' PHE . 21.5 m -116.26 147.5 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.712 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.421 ' HG ' ' CE3' ' A' ' 111' ' ' TRP . 22.6 tp -83.18 101.88 11.5 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -124.76 141.23 45.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.063 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.569 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 38.0 t80 -86.34 99.32 11.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.505 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -142.32 136.74 29.99 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 66.22 28.14 10.11 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -171.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.2 t70 72.0 -3.04 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.694 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.443 ' HE3' ' HB3' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -113.45 143.31 44.72 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.787 -0.57 . . . . 0.0 110.964 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.421 ' CE3' ' HG ' ' A' ' 104' ' ' LEU . 93.4 m95 -69.28 130.19 41.91 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 169.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.534 ' HB2' ' HA ' ' A' ' 89' ' ' HIS . . . -149.58 166.54 28.95 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.029 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.623 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 42.9 m0 -96.37 119.36 34.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.264 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.44 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 1.8 t30 -104.45 146.16 29.25 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.86 136.38 40.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.4 HG11 ' O ' ' A' ' 101' ' ' CYS . 4.5 p -158.67 143.84 11.91 Favored Pre-proline 0 C--N 1.317 -0.806 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.2 129.09 29.74 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.058 1.839 . . . . 0.0 110.609 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 99' ' ' GLU . 61.1 m -57.44 -28.21 63.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.219 0.533 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -90.85 70.66 6.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 170.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.446 ' O ' ' HA ' ' A' ' 23' ' ' THR . 83.9 t80 -138.14 133.69 33.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.528 175.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.433 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 28.2 mp0 -74.62 109.72 8.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.052 0.453 . . . . 0.0 110.629 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -142.84 179.62 6.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.027 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 48.9 m -74.35 168.47 19.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -137.06 147.82 46.39 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.695 -167.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.589 HG13 ' HB3' ' A' ' 60' ' ' TYR . 50.3 mt -132.23 122.23 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 168.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 82.4 m -118.09 143.54 46.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.221 0.534 . . . . 0.0 111.279 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.474 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 22.2 ptmt -112.97 143.02 44.98 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.5 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.555 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 10.0 tt -118.57 136.26 24.03 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.406 ' HG2' HG21 ' A' ' 131' ' ' THR . 19.3 Cg_endo -59.91 166.95 7.77 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.472 2.115 . . . . 0.0 111.96 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.479 ' HA2' ' N ' ' A' ' 1' ' ' MET . . . -44.14 -39.76 5.45 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.552 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.406 HG21 ' HG2' ' A' ' 129' ' ' PRO . 7.7 p 58.98 -12.07 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 173.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.458 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 24.2 p -58.91 -51.77 68.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.601 0.239 . . . . 0.0 110.648 177.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.6 mt -54.26 -24.33 18.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.739 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -87.1 -52.17 5.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.231 0.539 . . . . 0.0 110.229 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.01 22.48 3.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.49 -175.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 132' ' ' THR . 60.2 mm-40 -48.83 -66.14 0.45 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.067 0.46 . . . . 0.0 111.685 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 92.4 m-20 -74.72 -27.51 60.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.0 -46.22 90.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.76 -24.43 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . 0.407 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 86.5 t80 -67.15 -24.91 65.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 23.7 mt-30 -85.24 -5.19 59.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.439 178.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.831 -177.721 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.512 ' HA ' ' OG1' ' A' ' 132' ' ' THR . 28.1 ttt . . . . . 0 N--CA 1.48 1.062 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.752 ' H ' ' HB ' ' A' ' 132' ' ' THR . 52.7 t -122.29 125.22 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.993 0.425 . . . . 0.0 111.342 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 m -132.44 167.59 21.83 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 172.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.701 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 44.4 Cg_exo -56.66 163.32 7.21 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.221 1.947 . . . . 0.0 112.007 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.4 tp -56.87 122.15 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.3 t70 66.37 6.18 4.16 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.83 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.701 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 14.5 m95 -63.27 122.95 17.43 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 170.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.558 ' HB3' ' HB2' ' A' ' 15' ' ' TYR . 4.8 tpp180 -72.24 97.59 2.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.015 -165.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -76.42 121.78 23.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.051 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.405 ' HB3' ' OD1' ' A' ' 13' ' ' ASN . 85.1 t80 -132.2 102.21 5.69 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.864 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 67.68 -71.59 0.1 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.196 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -145.88 13.53 1.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.754 0.311 . . . . 0.0 111.47 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 26.0 p30 -132.29 169.26 16.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.437 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 92.6 m -139.77 133.87 31.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.965 0.412 . . . . 0.0 110.012 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.799 ' HE2' ' HG2' ' A' ' 39' ' ' MET . 45.4 m-85 -115.03 142.52 46.52 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -170.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -127.72 113.23 20.72 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.003 169.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -89.92 122.95 1.1 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.095 2.53 . . . . 0.0 112.148 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.476 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.6 mp -112.94 138.8 49.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.903 0.382 . . . . 0.0 110.099 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.428 HG22 ' HH ' ' A' ' 60' ' ' TYR . 19.8 p -105.65 9.5 33.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.497 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -82.38 136.29 35.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.973 0.416 . . . . 0.0 110.015 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.782 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 16.2 m120 -71.49 100.32 2.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.422 -176.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.526 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 21.2 mmmt -127.24 149.66 49.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.386 177.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 61.7 p -75.21 165.58 24.98 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.412 ' CZ3' ' HD2' ' A' ' 65' ' ' ARG . 68.4 t90 -56.81 -39.04 73.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.114 0.483 . . . . 0.0 110.276 -179.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -63.66 -50.88 67.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.91 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -64.84 -36.83 85.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.157 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.1 t -51.35 -47.82 62.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.189 174.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -74.82 -21.07 59.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.175 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 34.1 mmt-85 -82.7 -32.66 27.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.703 0.287 . . . . 0.0 111.339 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -83.32 -38.82 21.58 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.107 0.479 . . . . 0.0 109.916 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.547 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 96.8 m -85.68 177.8 7.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.798 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.509 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 35.7 m 76.88 -33.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.812 0.845 . . . . 0.0 110.511 -172.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 31' ' ' CYS . . . -62.84 -32.75 84.91 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.394 -0.431 . . . . 0.0 112.471 173.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 pmm? -95.25 1.63 54.63 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.956 0.378 . . . . 0.0 110.448 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.03 -6.41 66.62 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.791 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.476 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.02 140.16 30.35 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.488 ' HD2' ' OD2' ' A' ' 77' ' ' ASP . 33.0 t60 -118.66 165.51 13.89 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.04 133.96 8.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.988 0.423 . . . . 0.0 111.552 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.799 ' HG2' ' HE2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -58.54 103.73 0.17 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.492 0.663 . . . . 0.0 111.03 178.876 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.64 ' HA ' ' HZ3' ' A' ' 75' ' ' TRP . 2.0 t -94.3 118.91 32.3 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.412 168.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.562 HD11 ' CE ' ' A' ' 39' ' ' MET . 25.3 mm -61.3 119.95 6.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.4 m -102.75 -45.45 5.0 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.0 p -136.98 163.08 31.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 111.244 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -64.88 -40.56 95.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.052 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.41 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.47 -45.48 90.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.195 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -54.15 -50.45 66.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.726 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -51.7 -50.36 60.65 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.638 176.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -66.26 -41.43 89.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.951 -177.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.41 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 26.1 m-85 -70.19 -41.29 73.89 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.3 tp -69.96 -34.07 58.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.548 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.428 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 33.8 pt -71.91 -3.26 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 120.885 0.374 . . . . 0.0 111.349 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -87.46 -23.96 24.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.405 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 72.9 m-85 -93.14 -21.21 19.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -73.89 142.48 46.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.501 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 15.1 t70 -67.97 119.61 12.9 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.434 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.3 mtt180 -71.33 60.61 0.3 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.449 0.468 . . . . 0.0 111.742 -177.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.501 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 1.9 ttp180 -162.54 -29.32 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.293 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.443 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -92.35 173.98 7.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.381 0.61 . . . . 0.0 111.948 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.6 p -122.0 129.51 52.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.145 174.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.663 ' HB3' HG13 ' A' ' 125' ' ' ILE . 68.0 m-85 -114.17 126.23 54.83 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 -173.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.616 ' HA ' HG13 ' A' ' 103' ' ' VAL . 38.7 m-85 -61.98 146.94 48.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.1 mt -113.64 176.77 4.89 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.468 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.92 6.18 67.59 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 115.764 1.066 . . . . 0.0 115.764 -169.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.667 ' H ' HD22 ' A' ' 64' ' ' LEU . 1.4 pt? -103.48 138.54 40.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 118.861 1.331 . . . . 0.0 110.894 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.412 ' HD2' ' CZ3' ' A' ' 24' ' ' TRP . 30.3 ttt180 -136.86 137.81 40.09 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.672 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 7.6 t0 -109.82 154.22 23.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 161.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 2.9 pt-20 -145.02 -1.79 0.83 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -167.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -157.32 26.22 0.3 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.96 45.76 20.68 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.52 0.676 . . . . 0.0 109.229 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.672 ' HE2' ' HA ' ' A' ' 66' ' ' ASP . 35.9 mtmt -70.04 -47.29 62.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.104 -173.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.24 -26.76 8.35 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -173.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -89.14 100.06 12.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.092 -0.554 . . . . 0.0 109.615 176.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.521 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 92.1 m95 -70.97 142.83 51.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.579 0.704 . . . . 0.0 112.089 -175.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -140.47 120.12 13.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.699 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.64 ' HZ3' ' HA ' ' A' ' 40' ' ' THR . 40.7 m95 -79.15 147.21 32.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.912 175.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.424 HG22 ' HE2' ' A' ' 37' ' ' HIS . 11.2 p -75.01 -13.21 15.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.504 0.669 . . . . 0.0 109.996 178.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.513 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 4.6 m-20 -90.07 18.99 5.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.049 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.513 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 47.1 tp60 76.53 -19.72 0.4 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.231 0.612 . . . . 0.0 111.403 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.403 ' H ' ' C ' ' A' ' 77' ' ' ASP . 10.9 m -55.73 127.42 67.41 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 120.986 0.422 . . . . 0.0 111.556 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -72.55 158.94 50.08 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.532 2.155 . . . . 0.0 110.464 170.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.521 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 64.0 t80 -64.49 117.88 7.97 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.685 -178.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.565 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -90.72 110.79 43.96 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.706 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.99 -20.69 33.44 Favored 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.521 2.147 . . . . 0.0 112.444 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -104.55 2.88 31.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.523 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 3.6 mmp_? -123.2 22.48 9.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.116 0.484 . . . . 0.0 110.001 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.476 HG22 ' CZ3' ' A' ' 113' ' ' TRP . 14.6 p -99.52 140.75 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.174 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -124.15 74.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.82 0.343 . . . . 0.0 110.735 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -63.5 156.55 25.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.223 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.593 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 27.1 t-80 -70.73 -65.36 0.74 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.535 -172.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 16.3 mtpt -154.65 -79.99 0.09 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.73 0.776 . . . . 0.0 109.026 177.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -153.68 23.45 0.52 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.46 ' OE1' ' HB2' ' A' ' 90' ' ' LYS . 6.1 mp0 -57.72 135.07 82.84 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.529 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 9.0 Cg_exo -72.19 146.49 46.11 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.217 2.611 . . . . 0.0 112.645 -177.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -81.41 179.67 7.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.24 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.44 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 3.8 p30 -170.82 92.83 0.18 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.562 0.696 . . . . 0.0 110.843 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 44.5 t -161.96 167.76 24.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.884 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -127.63 12.24 6.85 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 177.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 171.0 -64.92 0.16 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.83 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.46 ' HB2' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -85.9 92.32 8.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.5 0.666 . . . . 0.0 110.763 -179.232 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -108.03 115.0 29.32 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.143 0.497 . . . . 0.0 110.207 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.507 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.439 ' CG2' HD23 ' A' ' 64' ' ' LEU . 2.1 m -88.74 147.7 5.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.218 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.616 HG13 ' HA ' ' A' ' 61' ' ' PHE . 29.0 m -127.43 154.47 37.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.639 176.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.9 mt -82.87 102.96 11.99 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 170.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.33 142.29 22.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.802 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -91.33 114.29 26.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.741 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.521 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -151.3 122.55 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.055 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 110' ' ' LYS . 50.0 mt-30 61.31 47.41 6.95 Favored 'General case' 0 CA--C 1.518 -0.264 0 O-C-N 123.981 0.8 . . . . 0.0 110.017 -176.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 13.6 t70 73.44 -28.3 0.19 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.936 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 108' ' ' GLN . 14.2 ptmm? -97.7 130.31 44.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.78 0.8 . . . . 0.0 112.383 -171.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.434 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 88.1 m95 -79.42 148.81 31.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.462 171.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.593 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -177.09 177.15 1.29 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.394 0.434 . . . . 0.0 111.012 173.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.476 ' CZ3' HG22 ' A' ' 86' ' ' VAL . 8.9 m0 -78.97 134.74 36.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.936 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -136.19 137.65 41.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -79.89 125.04 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.043 0.449 . . . . 0.0 111.343 -177.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.462 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 23.0 m -143.91 160.12 51.0 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.643 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 15.9 Cg_endo -58.58 140.36 94.45 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.096 1.864 . . . . 0.0 111.365 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 99' ' ' GLU . 61.6 m -72.02 -23.71 61.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.808 0.337 . . . . 0.0 110.497 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -94.66 53.21 1.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.53 0.681 . . . . 0.0 110.273 174.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.549 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 66.8 t80 -123.64 125.64 45.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.309 176.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.782 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 1.8 mp0 -68.75 109.3 3.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.974 0.416 . . . . 0.0 110.98 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.441 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -142.52 -177.94 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.877 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 37.9 m -80.53 172.21 14.05 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.789 0.328 . . . . 0.0 110.347 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.476 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 12.3 ptt180 -149.65 148.98 29.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.128 0.49 . . . . 0.0 112.101 -171.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.663 HG13 ' HB3' ' A' ' 60' ' ' TYR . 19.2 mt -119.79 121.55 66.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 173.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 87.5 m -112.62 126.32 55.24 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.265 0.555 . . . . 0.0 110.119 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.527 ' HG2' ' HA ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -112.16 124.93 53.5 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.471 -173.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.476 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 18.4 tt -106.8 144.2 28.59 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.896 -178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.463 ' HD2' HG13 ' A' ' 128' ' ' ILE . 7.9 Cg_endo -54.97 166.03 2.36 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.796 2.331 . . . . 0.0 112.503 172.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -64.53 89.97 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.548 173.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.6 p -61.21 2.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.752 ' HB ' ' H ' ' A' ' 2' ' ' VAL . 15.1 t -75.18 -5.1 42.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.618 179.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.4 mp -85.26 -26.31 26.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.701 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -88.91 -50.32 6.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.5 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -92.45 35.46 1.02 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.347 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.702 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -72.36 -67.99 0.51 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.443 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.702 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 3.8 p30 -86.81 -22.57 25.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 5.4 tt -55.64 -55.72 28.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -75.0 -19.76 59.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.216 0.531 . . . . 0.0 109.964 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.87 -31.51 70.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.043 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.525 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 81.6 mm-40 -86.19 -38.63 17.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.621 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.105 -177.211 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.701 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 56.9 ttp . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t -93.24 116.58 34.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 170.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.9 m -159.3 172.45 6.07 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -174.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_exo -57.85 152.24 51.43 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.845 1.697 . . . . 0.0 110.979 168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 15.4 tt -74.61 -18.72 16.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.069 0.461 . . . . 0.0 111.681 -171.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -74.57 -32.19 62.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.474 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 34.9 m95 -72.67 128.19 34.82 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.494 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 2.0 tpp180 -84.1 121.1 26.97 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.446 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.62 138.76 31.22 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.113 0.482 . . . . 0.0 111.972 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CB ' ' HE1' ' A' ' 15' ' ' TYR . 84.5 t80 -131.53 102.44 5.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 58.78 -96.51 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.707 -174.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.701 ' HA ' ' HB2' ' A' ' 1' ' ' MET . 19.0 t -105.81 -12.08 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.691 -178.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -93.54 164.49 13.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.697 0.284 . . . . 0.0 111.356 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.9 m -144.12 131.52 20.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.229 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.426 ' HE1' ' CB ' ' A' ' 10' ' ' PHE . 2.9 m-85 -123.5 134.77 53.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 -175.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.474 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 34.5 t80 -124.62 115.43 26.8 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 174.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -82.57 120.19 3.13 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.13 2.553 . . . . 0.0 112.24 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -99.29 139.12 35.42 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.995 0.426 . . . . 0.0 110.228 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.0 p -94.43 -3.29 50.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.41 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.421 ' CG ' ' HZ2' ' A' ' 22' ' ' LYS . 3.5 t70 -65.68 135.68 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.912 178.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.19 120.75 29.84 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.1 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 43.1 mmtm -144.25 150.97 38.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.363 177.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.96 158.94 33.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 167.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.421 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 82.5 t90 -52.48 -47.26 66.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.705 0.288 . . . . 0.0 111.358 -175.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.14 93.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.274 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.64 -27.13 63.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.955 0.407 . . . . 0.0 110.816 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.478 ' HG ' HD11 ' A' ' 38' ' ' LEU . 47.8 t -62.52 -43.95 97.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.18 175.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.551 ' OE2' HG12 ' A' ' 76' ' ' VAL . 8.7 tp10 -79.21 -21.39 46.35 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.311 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.32 -31.13 69.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.987 173.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.418 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.5 t-20 -85.41 -28.26 25.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.432 0.634 . . . . 0.0 109.742 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 80.9 m -84.61 -179.9 7.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 170.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 72.5 m 73.56 -45.79 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.755 0.422 . . . . 0.0 111.193 -175.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.08 -27.6 70.74 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.66 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 75.3 mtm -92.74 7.37 43.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.806 0.336 . . . . 0.0 110.472 176.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.69 -6.28 70.47 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.367 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.73 ' HB3' ' HB ' ' A' ' 128' ' ' ILE . . . -96.79 -177.71 3.99 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.538 0.209 . . . . 0.0 111.318 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -148.53 169.76 19.57 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.773 0.429 . . . . 0.0 110.009 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.478 HD11 ' HG ' ' A' ' 27' ' ' SER . 3.7 mm? -55.0 143.65 25.85 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.068 0.23 . . . . 0.0 110.496 173.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.615 ' HE1' HG12 ' A' ' 41' ' ' ILE . 14.3 tpt -49.6 109.6 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.654 0.596 . . . . 0.0 111.884 -177.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.537 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 27.3 p -107.92 106.76 17.17 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.326 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.615 HG12 ' HE1' ' A' ' 39' ' ' MET . 54.9 mt -81.62 116.13 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.932 -176.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.3 p -102.89 -31.56 10.2 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.04 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.6 p -131.16 159.44 37.68 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.522 0.677 . . . . 0.0 111.904 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.428 ' HG3' ' HE ' ' A' ' 85' ' ' ARG . 19.8 mt-10 -68.42 -39.41 81.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.711 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.26 -33.52 74.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.597 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -58.84 -50.35 74.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.164 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.431 ' O ' HG22 ' A' ' 51' ' ' ILE . 34.3 tt0 -57.63 -55.44 34.76 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 35.2 m-80 -59.17 -36.96 76.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.069 -175.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -69.49 -47.22 64.57 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 121.278 -0.169 . . . . 0.0 111.106 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.504 HG21 ' HE3' ' A' ' 39' ' ' MET . 8.8 tp -70.59 -33.98 55.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.011 0.434 . . . . 0.0 111.58 -174.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.791 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.9 pt -71.06 -11.19 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.946 0.403 . . . . 0.0 110.938 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.9 mt-30 -76.91 -27.55 54.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.634 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.44 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 55.1 m-85 -90.14 -21.77 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.596 -179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.43 150.07 40.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.262 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -67.84 -13.48 62.17 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.701 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.577 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 49.5 mtp180 66.84 30.55 7.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.911 0.386 . . . . 0.0 111.099 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' HD21 ' A' ' 58' ' ' LEU . 3.7 ttm180 -132.21 -56.36 0.97 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.832 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.62 HD21 ' HB3' ' A' ' 57' ' ' ARG . 2.7 mm? -83.27 170.96 14.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.453 -174.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -111.82 125.72 54.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.468 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.587 ' HB3' HG13 ' A' ' 125' ' ' ILE . 21.3 m-85 -108.76 126.52 53.11 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -171.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.438 ' HA ' HG11 ' A' ' 103' ' ' VAL . 13.7 m-85 -60.54 149.94 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.745 ' HB2' HG11 ' A' ' 102' ' ' VAL . 90.4 mt -120.91 -178.93 3.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.298 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.53 ' CA ' HG23 ' A' ' 76' ' ' VAL . . . -81.86 -17.94 68.97 Favored Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.749 -0.738 . . . . 0.0 114.193 -176.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.609 ' HB2' ' CG1' ' A' ' 102' ' ' VAL . 83.7 mt -71.78 121.53 19.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 117.666 0.733 . . . . 0.0 110.455 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 ptm85 -129.19 161.76 29.4 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.597 0.713 . . . . 0.0 112.32 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.651 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 1.8 t70 -135.61 151.52 50.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.676 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.982 ' HG2' ' HD2' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -112.07 -33.51 6.23 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -161.42 71.3 0.38 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.251 -172.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.81 36.43 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.041 0.448 . . . . 0.0 111.449 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.982 ' HD2' ' HG2' ' A' ' 67' ' ' GLU . 32.3 mtpt -63.03 127.86 33.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.451 -177.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.65 -14.64 82.21 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.118 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.402 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 4.1 pt20 -107.8 113.64 27.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.276 0.56 . . . . 0.0 110.251 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.535 ' HE3' ' HB3' ' A' ' 64' ' ' LEU . 44.9 m95 -99.33 158.65 15.56 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.779 -178.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.5 ' HG2' ' N ' ' A' ' 75' ' ' TRP . 3.6 ttt180 -152.04 149.38 28.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.537 176.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.537 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 82.4 m95 -82.74 -174.65 5.35 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.568 0.542 . . . . 0.0 109.756 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.551 HG12 ' OE2' ' A' ' 28' ' ' GLU . 35.5 t -81.82 -65.09 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.89 -77.88 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.61 -18.07 0.14 Allowed 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 16.8 m -57.03 118.24 22.76 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.875 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.33 169.71 20.12 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.042 2.495 . . . . 0.0 111.542 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 77.1 t80 -60.49 137.45 58.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 110.001 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -97.24 118.86 64.14 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.784 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.51 -46.61 20.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.327 2.685 . . . . 0.0 113.879 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -85.5 -31.51 22.72 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.592 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -92.08 80.03 5.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 110.133 -176.256 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.0 t -128.61 103.87 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.507 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -127.35 67.51 1.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.338 -173.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.49 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 86.1 m95 -84.93 -166.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.855 0.359 . . . . 0.0 110.595 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.606 ' CE1' ' HB2' ' A' ' 112' ' ' ALA . 69.1 m-70 -123.78 116.42 22.97 Favored 'General case' 0 CA--C 1.514 -0.404 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 174.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.456 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.8 tppt? -61.23 110.42 1.4 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.145 0.974 . . . . 0.0 110.881 -177.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.4 ' N ' ' HD3' ' A' ' 90' ' ' LYS . 24.5 t-20 160.58 -51.99 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 112.507 -2.133 . . . . 0.0 107.393 -171.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.456 ' OE2' ' HA ' ' A' ' 90' ' ' LYS . 2.2 mp0 35.66 94.78 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.546 0 O-C-N 124.94 1.4 . . . . 0.0 111.77 -176.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -61.18 99.42 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.377 2.718 . . . . 0.0 114.04 -170.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.09 67.88 7.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.949 0.88 . . . . 0.0 108.856 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -122.46 -28.8 4.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.95 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.1 m -140.56 90.42 2.35 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.741 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.91 109.65 15.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.508 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.18 143.28 5.75 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 -176.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.409 ' HA ' ' O ' ' A' ' 66' ' ' ASP . 19.0 mt-10 55.88 33.74 22.2 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -177.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 66' ' ' ASP . 0.9 OUTLIER -75.69 93.75 3.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.544 0.688 . . . . 0.0 110.717 -178.469 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.3 m -102.45 139.66 37.77 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.745 HG11 ' HB2' ' A' ' 62' ' ' LEU . 13.8 p -91.53 145.68 7.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -169.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.438 HG11 ' HA ' ' A' ' 61' ' ' PHE . 19.8 m -128.84 155.28 40.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.595 174.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.661 ' HG ' HD13 ' A' ' 62' ' ' LEU . 23.1 mt -88.35 118.92 28.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 171.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -130.37 141.62 45.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.42 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -75.64 108.37 8.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.703 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.428 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.9 t-20 -159.08 143.18 15.3 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -177.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 66.73 35.33 5.19 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.314 0.578 . . . . 0.0 109.748 -173.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.69 4.11 4.85 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 114.548 -1.206 . . . . 0.0 112.691 174.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.5 175.44 10.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.882 0.372 . . . . 0.0 110.288 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.791 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 82.2 m95 -85.69 137.64 32.68 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 173.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.606 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . . . -154.93 174.22 15.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.481 176.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.49 ' HB2' ' HA ' ' A' ' 88' ' ' TRP . 51.9 m0 -81.04 136.5 35.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.522 -172.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -129.93 130.07 44.64 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.112 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.82 123.92 27.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.193 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.24 158.63 63.72 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.529 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.43 135.89 67.51 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.332 2.021 . . . . 0.0 111.018 171.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -27.39 66.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.762 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -86.67 60.34 6.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.824 0.821 . . . . 0.0 110.639 175.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -137.25 116.78 12.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.059 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -63.1 117.98 7.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.071 0.462 . . . . 0.0 111.632 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -144.39 -176.39 5.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.89 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.3 m -78.51 171.82 14.56 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.622 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -152.45 135.66 15.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -167.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.587 HG13 ' HB3' ' A' ' 60' ' ' TYR . 67.6 mt -105.85 127.45 60.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 172.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.74 121.95 45.75 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -112.28 129.2 56.36 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.897 -175.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.73 ' HB ' ' HB3' ' A' ' 36' ' ' ALA . 10.2 tt -129.87 141.13 40.78 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -70.9 166.8 27.84 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.087 1.858 . . . . 0.0 110.57 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.38 57.74 1.57 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.964 176.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -106.07 17.52 23.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.078 0.466 . . . . 0.0 110.98 -173.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 m -61.05 -20.08 62.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.148 0.499 . . . . 0.0 111.228 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.468 HD13 ' N ' ' A' ' 133' ' ' LEU . 5.0 mp -79.84 -26.94 40.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.668 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -88.04 -37.54 16.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.221 0.534 . . . . 0.0 109.91 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.14 40.56 0.99 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.738 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.58 -57.36 11.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.986 -174.421 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.505 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 9.3 m-80 -74.26 -24.03 59.22 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.75 0.309 . . . . 0.0 110.625 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.97 -51.68 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -70.74 -23.52 62.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.394 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -70.88 -31.72 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.547 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -89.03 -6.37 57.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.456 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.833 -177.314 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.3 m -93.43 165.0 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 169.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HB2' HG23 ' A' ' 132' ' ' THR . 72.8 m -110.03 114.23 56.27 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-O 120.981 0.419 . . . . 0.0 112.052 -175.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.88 169.17 19.69 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.829 2.352 . . . . 0.0 110.915 171.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.5 pt -72.27 -18.51 19.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.92 -49.49 70.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.985 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 25.2 m95 -62.05 139.24 58.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.889 178.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.474 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 14.1 mmm180 -84.71 129.51 34.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 111.315 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.37 121.46 42.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.933 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.449 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.4 t80 -121.41 105.16 10.25 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 69.55 -61.98 0.43 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.009 0.818 . . . . 0.0 110.956 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.8 m -152.31 -25.83 0.17 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.795 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -82.9 156.46 23.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -175.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.606 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 23.5 m -120.05 137.71 53.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.134 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.449 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 16.7 m-85 -131.8 135.15 46.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.651 0.262 . . . . 0.0 110.72 -175.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 41.5 t80 -134.17 117.16 13.5 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.128 175.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -84.65 129.31 4.15 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.727 2.285 . . . . 0.0 112.258 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.699 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -104.75 139.35 39.68 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.835 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.5 p -105.53 3.31 29.26 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.214 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -88.08 137.2 32.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.639 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 94.5 m-20 -74.51 122.97 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.279 0.561 . . . . 0.0 111.587 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.565 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 43.7 mmtm -141.19 151.31 43.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.01 175.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 63.5 p -73.07 170.44 14.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 172.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.634 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 20.8 t90 -62.6 -35.93 81.11 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.285 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.583 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -62.76 -51.62 66.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.55 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.565 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 11.0 mm-40 -61.53 -34.65 75.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.777 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.534 ' HB3' HD13 ' A' ' 38' ' ' LEU . 56.4 m -64.9 -45.07 87.46 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.367 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 17.2 pt-20 -73.74 -24.92 59.96 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.07 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.5 mtm180 -78.63 -49.67 12.82 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.874 0.369 . . . . 0.0 111.166 177.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.32 -31.53 71.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 32' ' ' SER . 1.3 t -84.52 177.94 7.9 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 172.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 20.6 m 76.88 -46.54 0.51 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 122.506 0.322 . . . . 0.0 110.675 -176.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.63 -33.15 75.95 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 121.221 -0.514 . . . . 0.0 111.937 174.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -79.57 2.07 23.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.849 0.356 . . . . 0.0 110.745 176.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.13 47.85 17.03 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.657 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -148.54 -177.41 5.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -150.64 169.52 21.38 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 173.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.658 ' HB2' HG23 ' A' ' 76' ' ' VAL . 4.1 mm? -57.18 138.8 54.16 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 171.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.908 ' HE2' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -48.88 108.64 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.844 0.715 . . . . 0.0 112.325 -173.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -93.33 88.97 6.18 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.723 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.908 HG12 ' HE2' ' A' ' 39' ' ' MET . 48.2 mt -57.17 111.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.083 -176.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.1 m -93.0 -32.7 14.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.78 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.477 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 2.9 t -138.75 153.85 48.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.0 112.128 -177.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.457 ' HG3' ' NH1' ' A' ' 85' ' ' ARG . 23.0 mt-10 -61.5 -35.26 77.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.79 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.426 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -63.58 -34.94 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.224 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.489 ' CD ' ' HZ3' ' A' ' 127' ' ' LYS . 57.8 tt0 -61.0 -51.41 69.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.316 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.455 ' HA ' HG23 ' A' ' 50' ' ' ILE . 50.6 tt0 -62.51 -40.35 96.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.064 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.99 -27.86 69.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.426 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 20.8 m-85 -88.3 -34.28 17.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.599 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -69.05 -33.39 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.861 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.5 pt -71.29 -4.45 4.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.86 0.362 . . . . 0.0 111.141 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.93 -27.46 26.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.717 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -89.91 -27.03 20.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.385 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.3 mt -74.89 129.45 37.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.168 -176.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.17 125.85 24.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.753 174.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.414 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.0 mtp180 -75.15 59.23 0.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.578 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.52 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -161.9 -30.93 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.724 177.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.52 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -84.26 172.62 11.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.0 -178.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 m -122.38 122.73 39.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.26 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.582 ' HB3' HG13 ' A' ' 125' ' ' ILE . 70.6 m-85 -110.37 122.04 46.74 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -170.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.575 ' HA ' HG13 ' A' ' 103' ' ' VAL . 39.6 m-85 -60.49 130.54 47.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.964 0.411 . . . . 0.0 111.361 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 104' ' ' LEU . 95.7 mt -99.95 174.37 6.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.197 178.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.474 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.75 47.95 3.9 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.322 -177.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.32 126.97 49.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.705 0.253 . . . . 0.0 110.359 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.634 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 8.1 ttm180 -124.61 124.12 41.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 176.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 39.1 t0 -116.96 153.72 32.13 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 163.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.708 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 27.9 tt0 -146.87 108.58 4.34 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.278 -168.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.594 HD21 ' HG2' ' A' ' 67' ' ' GLU . 48.8 m-80 68.53 23.83 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.744 0.653 . . . . 0.0 110.674 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.464 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 62.27 84.74 0.13 Allowed 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.985 0.803 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.708 ' HZ3' ' HB3' ' A' ' 67' ' ' GLU . 64.7 mttp -100.02 157.25 16.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.331 177.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -84.71 -12.34 75.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.094 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -123.8 102.34 7.75 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.338 0.589 . . . . 0.0 110.415 178.241 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 11.7 m0 -78.51 167.91 20.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.272 178.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.598 ' NH2' ' HA ' ' A' ' 78' ' ' GLN . 43.8 ttt-85 -144.11 143.6 31.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.277 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.474 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 67.7 m95 -78.75 167.17 21.59 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.658 HG23 ' HB2' ' A' ' 38' ' ' LEU . 69.4 t -60.06 -50.44 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.782 0.325 . . . . 0.0 110.999 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -96.94 77.79 2.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.964 0.411 . . . . 0.0 111.383 -174.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.598 ' HA ' ' NH2' ' A' ' 74' ' ' ARG . 44.5 tp60 69.36 -48.59 0.6 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 169.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 24.1 m -48.69 126.74 13.48 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 122.861 0.464 . . . . 0.0 112.083 -173.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -76.6 166.33 27.42 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.979 2.453 . . . . 0.0 111.776 176.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.556 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 84.1 t80 -53.82 132.79 42.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.14 0.495 . . . . 0.0 110.998 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -112.73 112.78 50.63 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.498 -175.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -67.43 -16.17 47.05 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.181 2.587 . . . . 0.0 112.929 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.5 tpp180 -100.48 -20.42 15.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.432 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.457 ' NH1' ' HG3' ' A' ' 44' ' ' GLU . 8.6 tpp180 -114.28 70.49 0.73 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.53 0.681 . . . . 0.0 110.11 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.1 p -151.27 142.07 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.754 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -118.3 -37.88 3.27 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.882 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.437 ' O ' ' HB1' ' A' ' 112' ' ' ALA . 99.3 m95 59.11 -165.02 0.2 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.139 -174.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.524 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 12.0 t-80 -111.68 -61.52 1.69 Allowed 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.031 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 1.9 tmmt? 173.27 -36.63 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 124.007 0.817 . . . . 0.0 109.194 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -151.43 115.88 5.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.081 171.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.443 ' H ' ' CD ' ' A' ' 92' ' ' GLU . 3.3 pm0 -57.97 122.7 59.74 Favored Pre-proline 0 C--N 1.315 -0.932 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.651 173.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 9.9 Cg_endo -90.45 129.43 1.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.114 2.542 . . . . 0.0 112.643 -178.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -73.42 115.77 13.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.401 0.62 . . . . 0.0 110.357 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 175.6 -44.8 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.477 -1.238 . . . . 0.0 107.749 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 6.0 p -87.31 74.16 9.52 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.325 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -111.77 127.23 55.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.424 ' HA2' ' HA ' ' A' ' 68' ' ' ASN . . . 93.49 -55.36 2.37 Favored Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -171.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.664 ' HB3' ' H ' ' A' ' 118' ' ' CYS . 40.0 mt-10 -114.09 104.2 11.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 171.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.534 ' HB3' ' O ' ' A' ' 96' ' ' SER . 2.1 p-10 -138.66 93.21 2.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 122.002 0.906 . . . . 0.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 97.5 m -110.28 121.99 46.6 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.878 177.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 35.3 m -74.4 136.49 25.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.311 0.577 . . . . 0.0 111.442 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.575 HG13 ' HA ' ' A' ' 61' ' ' PHE . 32.8 m -116.89 154.93 18.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.609 176.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.485 ' HB2' HD23 ' A' ' 62' ' ' LEU . 13.8 tp -83.59 100.86 11.08 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -120.18 143.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.433 0.635 . . . . 0.0 111.784 -171.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.411 ' CE1' ' HB3' ' A' ' 56' ' ' ARG . 65.5 t80 -83.61 97.03 8.85 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.76 176.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.524 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -143.83 131.48 21.25 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 85.6 mt-30 66.62 29.34 8.9 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 123.824 0.703 . . . . 0.0 109.302 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 t70 72.82 -14.61 0.57 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.625 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -108.23 138.73 44.02 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.394 0.616 . . . . 0.0 111.245 -176.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.414 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 92.8 m95 -74.68 131.83 41.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.14 176.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.474 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -160.78 167.36 26.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.765 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.431 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 14.7 m0 -80.2 121.46 25.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.785 -177.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -123.83 130.89 53.34 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.531 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.09 125.02 25.77 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.8 m -137.2 159.49 69.51 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.201 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.6 134.99 47.95 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.054 1.836 . . . . 0.0 110.577 172.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.664 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 61.0 m -69.17 -35.43 76.29 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.805 0.336 . . . . 0.0 110.364 -175.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.517 ' HA ' ' HB ' ' A' ' 23' ' ' THR . 5.6 t30 -85.49 72.55 10.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.594 0.712 . . . . 0.0 109.412 170.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 23' ' ' THR . 84.9 t80 -137.85 131.59 31.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.95 -1.023 . . . . 0.0 108.798 176.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 26.0 mp0 -75.28 110.15 9.38 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.979 0.419 . . . . 0.0 110.878 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.492 ' HB1' ' CE2' ' A' ' 61' ' ' PHE . . . -146.76 -177.25 5.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.199 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 16.1 m -79.37 173.98 12.03 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.699 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 13.4 ptt180 -154.65 158.84 40.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.818 0.342 . . . . 0.0 111.686 -171.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.582 HG13 ' HB3' ' A' ' 60' ' ' TYR . 49.3 mt -127.17 126.6 68.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.874 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 17.9 m -103.09 131.57 49.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 174.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.489 ' HZ3' ' CD ' ' A' ' 46' ' ' GLU . 86.6 tttt -119.2 131.31 55.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.032 -176.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.606 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 81.1 mt -107.81 134.23 20.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.126 173.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -67.01 166.33 23.26 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.215 1.943 . . . . 0.0 111.344 177.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.09 54.61 1.44 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.132 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 8.9 t -99.14 -19.06 17.37 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.816 -0.226 . . . . 0.0 110.897 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.465 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 4.4 t -65.93 -37.08 85.12 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.432 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 91.0 mt -58.83 -33.61 70.6 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.069 0.461 . . . . 0.0 111.27 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -81.61 -31.25 32.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.306 0.574 . . . . 0.0 109.678 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.51 7.8 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.052 -177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 132' ' ' THR . 50.6 mm-40 -62.88 -38.1 89.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.422 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 8.7 t30 -69.44 -32.95 72.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.975 176.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.28 -43.84 85.23 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -71.83 -20.75 61.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -68.93 -30.73 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.409 0.623 . . . . 0.0 109.635 173.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 14.3 mt-30 -86.53 -41.26 14.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.985 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.665 -177.88 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.513 ' HA ' HG21 ' A' ' 132' ' ' THR . 4.2 ppp? . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.503 HG12 ' CG2' ' A' ' 132' ' ' THR . 3.2 p -154.56 124.48 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 121.381 0.61 . . . . 0.0 110.646 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 m -160.36 156.6 23.16 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -57.25 146.89 79.79 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.01 1.806 . . . . 0.0 110.994 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.86 -27.8 28.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.195 0.521 . . . . 0.0 110.753 -174.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -71.61 -34.88 70.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.079 176.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -69.88 141.86 53.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.672 ' HD3' ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -91.41 112.16 23.95 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.715 -174.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.79 133.53 35.12 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.022 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.453 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 79.1 t80 -138.68 102.57 4.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.977 178.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 63.74 -81.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.966 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.0 m -135.88 12.77 3.39 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.922 0.391 . . . . 0.0 110.986 -176.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -128.02 158.14 38.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.238 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 75.4 m -136.32 127.76 28.52 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 0.0 110.093 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 13.2 m-85 -118.54 138.49 52.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.383 -173.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -118.63 112.81 36.79 Favored Pre-proline 0 C--N 1.318 -0.789 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.884 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -89.8 121.56 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.197 2.598 . . . . 0.0 112.336 178.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.774 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.1 mm? -107.74 138.89 43.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.085 0.469 . . . . 0.0 110.884 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 p -90.87 -5.41 55.58 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.886 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.03 130.35 46.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.201 -1.363 . . . . 0.0 111.201 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -80.49 112.02 17.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.214 -175.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.622 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 39.2 mmtm -143.49 151.15 39.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.866 178.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 43.1 p -74.74 172.21 12.55 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 70.0 t90 -57.04 -41.53 78.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.091 0.472 . . . . 0.0 110.607 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -67.29 -45.19 77.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.397 -178.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.622 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 42.8 mt-10 -64.48 -36.63 84.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.46 -177.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.587 ' HG ' HD11 ' A' ' 38' ' ' LEU . 31.7 t -56.69 -44.71 81.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.761 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -79.53 -21.52 45.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.584 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 96.7 mtt180 -69.65 -40.15 76.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.895 0.379 . . . . 0.0 110.766 176.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -78.21 -31.23 49.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.346 0.593 . . . . 0.0 110.151 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 32' ' ' SER . 89.0 m -86.89 179.52 6.71 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.324 174.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 70.1 m 74.02 -40.15 0.45 Allowed 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.493 0.717 . . . . 0.0 110.472 -172.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.94 73.6 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 170.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.9 mtm -92.88 7.04 45.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.825 0.345 . . . . 0.0 110.542 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.05 -14.64 48.22 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.664 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 31' ' ' CYS . . . -95.32 141.69 28.6 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.775 -0.25 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.56 ' CD2' HG11 ' A' ' 76' ' ' VAL . 19.9 t60 -118.31 150.52 39.35 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.587 HD11 ' HG ' ' A' ' 27' ' ' SER . 3.3 mp -44.77 131.61 6.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.909 0.385 . . . . 0.0 111.929 -175.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.781 ' HE2' HG12 ' A' ' 41' ' ' ILE . 27.8 ttt -54.0 117.75 3.46 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.736 -169.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.562 HG23 ' OD1' ' A' ' 77' ' ' ASP . 19.2 p -104.79 97.07 7.01 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.22 174.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.781 HG12 ' HE2' ' A' ' 39' ' ' MET . 58.2 mt -66.09 113.17 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.408 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 m -94.66 -35.43 12.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.659 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 1.8 t -131.31 151.52 51.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.667 0.746 . . . . 0.0 111.887 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -59.83 -35.96 75.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.961 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.464 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.84 -41.06 97.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.997 0.427 . . . . 0.0 110.206 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.476 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.4 tt0 -55.02 -50.75 68.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.984 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.434 ' O ' HG22 ' A' ' 51' ' ' ILE . 51.9 tt0 -65.57 -49.24 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 178.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -59.33 -28.07 66.49 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -175.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.464 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 23.8 m-85 -85.97 -42.79 13.71 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.655 178.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.3 tp -68.17 -30.51 48.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.203 -175.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.629 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.0 pt -73.41 -2.64 3.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.479 -177.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -87.62 -23.12 24.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.826 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.672 ' CE1' ' HD3' ' A' ' 8' ' ' ARG . 83.1 m-85 -95.78 -24.95 16.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.602 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -69.51 141.92 53.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.286 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.617 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 13.7 t70 -70.03 117.5 11.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.533 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 80.6 mtt180 -76.34 55.79 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.302 0.572 . . . . 0.0 111.405 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.617 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 4.2 ttp180 -154.16 -32.68 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.22 152.78 18.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.054 0.454 . . . . 0.0 111.196 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 p -102.0 122.8 44.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.657 173.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.56 ' HB3' HG13 ' A' ' 125' ' ' ILE . 82.7 m-85 -102.25 127.57 49.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.369 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.536 ' HA ' HG11 ' A' ' 103' ' ' VAL . 26.6 m-85 -65.35 139.32 58.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.928 0.394 . . . . 0.0 111.577 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.76 HD12 ' HG ' ' A' ' 104' ' ' LEU . 86.2 mt -111.69 172.81 6.67 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.324 176.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -77.51 -5.36 85.86 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.535 -177.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.513 HD11 ' HB3' ' A' ' 73' ' ' TRP . 28.6 tp -73.68 115.65 13.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.266 0.533 . . . . 0.0 110.113 -178.45 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HD3' ' HB3' ' A' ' 67' ' ' GLU . 21.4 ttm180 -113.04 144.05 43.26 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.394 -172.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.499 ' CG ' ' HZ1' ' A' ' 70' ' ' LYS . 11.3 t0 -129.69 127.07 39.76 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 153.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.514 ' HB3' ' HD3' ' A' ' 65' ' ' ARG . 1.0 OUTLIER -105.89 14.38 28.12 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -172.211 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.5 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -163.95 17.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.93 178.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.33 40.13 31.49 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.502 0.668 . . . . 0.0 109.844 -174.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.632 ' HE2' ' HB2' ' A' ' 72' ' ' GLN . 14.2 mtmm -71.53 -24.9 62.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.736 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.26 6.7 70.86 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -174.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.632 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . 74.0 mt-30 -117.66 90.22 3.29 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.473 -178.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.542 ' CH2' HG12 ' A' ' 102' ' ' VAL . 98.6 m95 -72.26 129.92 39.57 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.167 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 62.8 mtm180 -132.48 142.7 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.428 ' CE3' HG21 ' A' ' 40' ' ' THR . 98.2 m95 -74.16 169.91 16.6 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.886 0.374 . . . . 0.0 110.452 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.56 HG11 ' CD2' ' A' ' 37' ' ' HIS . 12.7 p -78.78 -3.4 5.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.175 0.512 . . . . 0.0 111.723 -170.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.562 ' OD1' HG23 ' A' ' 40' ' ' THR . 3.4 p-10 -98.89 -80.79 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 175.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.506 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 0.9 OUTLIER -160.14 -23.77 0.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.006 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.427 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.6 m -54.53 130.49 63.17 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.805 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 2.9 Cg_exo -77.15 165.78 27.5 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.903 2.402 . . . . 0.0 111.536 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.58 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 91.4 t80 -58.27 132.33 53.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.003 0.43 . . . . 0.0 110.692 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.559 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 0.8 OUTLIER -85.5 122.85 73.38 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.059 -176.862 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -60.99 -18.42 57.5 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.853 2.369 . . . . 0.0 113.359 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.6 mtt180 -113.34 16.96 18.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 111.35 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.559 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 19.8 mmt180 -120.57 80.24 1.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 171.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.5 t -126.81 105.04 13.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.032 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.45 96.14 4.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.875 -177.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -121.21 -173.63 2.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.934 0.397 . . . . 0.0 110.625 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.436 ' CE1' ' HB1' ' A' ' 112' ' ' ALA . 95.4 m-70 -108.74 -166.25 1.1 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 91' ' ' ASN . 2.0 tmtp? -110.33 119.37 39.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.096 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.46 ' N ' ' HD3' ' A' ' 90' ' ' LYS . 17.7 t-20 61.45 76.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.191 0.932 . . . . 0.0 110.819 -179.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -95.2 156.94 37.21 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 118.26 5.22 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.856 2.371 . . . . 0.0 113.286 -176.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -82.64 3.29 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.876 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -94.44 4.14 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -171.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.5 m -85.47 78.82 9.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.256 0.55 . . . . 0.0 110.24 178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -104.71 148.21 26.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.89 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 149.54 -108.77 0.41 Allowed Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.772 ' HG2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -104.89 -44.31 4.86 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 172.13 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.9 t30 78.27 118.16 0.06 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.164 0.986 . . . . 0.0 113.477 169.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.46 152.98 46.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.236 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.605 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 27.5 m -98.36 140.62 17.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.236 0.541 . . . . 0.0 111.209 179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.536 HG11 ' HA ' ' A' ' 61' ' ' PHE . 33.2 m -122.96 153.1 27.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 174.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.76 ' HG ' HD12 ' A' ' 62' ' ' LEU . 15.0 mt -82.89 110.58 18.01 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 173.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.7 p -123.56 136.98 58.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.683 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.452 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 58.0 t80 -82.06 96.15 7.67 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.353 176.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 108' ' ' GLN . 27.0 t-20 -143.89 135.33 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 52.4 mt-30 67.87 27.67 7.24 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -173.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 59.55 17.79 6.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.295 -1.321 . . . . 0.0 112.699 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -130.8 136.23 48.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.004 0.43 . . . . 0.0 110.251 175.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.629 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 80.0 m95 -76.65 104.45 7.16 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.683 175.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.436 ' HB1' ' CE1' ' A' ' 89' ' ' HIS . . . -137.83 160.99 37.78 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.215 -178.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.605 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 25.0 m0 -72.91 149.45 43.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -176.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.44 HD21 HG11 ' A' ' 116' ' ' VAL . 4.8 t30 -137.37 131.19 31.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.364 175.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.35 123.74 21.58 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 123.655 0.597 . . . . 0.0 110.547 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.44 HG11 HD21 ' A' ' 114' ' ' ASN . 18.6 m -146.52 151.66 43.77 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.586 177.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.69 135.53 62.45 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.201 1.934 . . . . 0.0 110.683 172.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.772 ' SG ' ' HG2' ' A' ' 99' ' ' GLU . 46.6 m -67.67 -20.6 65.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.916 0.389 . . . . 0.0 110.579 -176.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.438 ' C ' HD21 ' A' ' 119' ' ' ASN . 0.2 OUTLIER -91.43 66.72 5.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.464 0.65 . . . . 0.0 109.305 173.564 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -137.67 114.4 10.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.824 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.02 109.87 1.62 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.114 0.483 . . . . 0.0 110.826 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -143.54 -171.19 3.46 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.964 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 57.3 m -82.52 173.06 12.32 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.774 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -150.48 152.94 35.0 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -167.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.56 HG13 ' HB3' ' A' ' 60' ' ' TYR . 55.9 mt -136.97 131.41 46.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.96 177.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 90.2 m -120.24 143.89 48.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.184 0.516 . . . . 0.0 110.688 176.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -120.44 129.79 54.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.294 -0.867 . . . . 0.0 111.043 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.6 tt -124.22 144.89 46.83 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.93 156.49 43.69 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 121.7 1.6 . . . . 0.0 110.48 169.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.487 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -62.8 -11.09 35.03 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.003 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 58.5 p 62.96 -14.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.803 1.241 . . . . 0.0 113.501 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.646 ' HB ' ' HG2' ' A' ' 136' ' ' GLU . 23.1 p -79.16 -3.1 43.99 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.856 ' H ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -54.36 -33.64 59.51 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.303 172.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.618 ' H ' HD21 ' A' ' 133' ' ' LEU . 51.4 t-20 -90.89 -44.07 9.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.266 168.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.508 ' HB1' ' HA ' ' A' ' 132' ' ' THR . . . -86.24 0.83 52.86 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -164.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.646 ' HG2' ' HB ' ' A' ' 132' ' ' THR . 5.1 mm-40 -68.71 -44.63 73.49 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 44.2 t30 -71.48 -34.8 70.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.013 176.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.58 -46.45 89.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -66.01 -31.02 71.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.171 177.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.54 -42.54 67.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.212 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.5 mm-40 -78.05 -14.7 59.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.726 -175.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.346 -178.55 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.541 ' HE3' ' HB3' ' A' ' 12' ' ' SER . 75.0 mtm . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 p -147.0 157.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.709 0.29 . . . . 0.0 110.992 -175.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.6 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.6 m -134.71 -178.8 0.93 Allowed Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.6 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 81.7 Cg_exo -48.48 150.2 6.03 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 121.828 1.685 . . . . 0.0 111.655 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.07 -17.17 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -169.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -78.75 -33.0 46.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.069 0.461 . . . . 0.0 109.964 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 76.2 m95 -79.92 115.78 19.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.6 tpt180 -72.81 104.67 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.214 0.53 . . . . 0.0 110.358 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.2 133.27 42.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.198 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -134.73 102.24 5.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.411 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.73 -82.89 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.554 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.541 ' HB3' ' HE3' ' A' ' 1' ' ' MET . 56.6 m -133.49 2.38 3.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.821 0.344 . . . . 0.0 111.389 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -117.79 162.9 17.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.8 m -137.98 133.43 33.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.807 0.337 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -127.12 127.9 45.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.716 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.491 ' CD2' HD21 ' A' ' 18' ' ' LEU . 49.2 t80 -104.11 113.23 65.46 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 8.5 Cg_endo -89.96 119.41 0.81 Allowed 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 123.537 2.824 . . . . 0.0 111.597 174.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.491 HD21 ' CD2' ' A' ' 16' ' ' PHE . 1.1 pt? -135.31 140.57 45.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.448 0.642 . . . . 0.0 110.821 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.435 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 34.0 p -101.54 17.71 22.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.92 -172.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -73.23 141.37 47.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.528 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 18.5 m120 -67.8 118.7 11.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.571 -178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.858 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 2.3 mmpm? -159.89 146.91 16.38 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.582 0.753 . . . . 0.0 109.519 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.483 HG22 ' OE2' ' A' ' 121' ' ' GLU . 58.1 p -82.32 177.83 8.56 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.218 178.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.499 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 84.0 t90 -61.02 -45.68 93.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.91 82.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.595 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.858 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 21.9 mm-40 -63.6 -38.48 91.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.46 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.862 ' HG ' HD13 ' A' ' 38' ' ' LEU . 34.3 t -60.65 -48.66 80.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.803 0.335 . . . . 0.0 110.247 177.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -66.73 -27.02 67.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.67 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -82.83 -46.18 13.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.136 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -69.84 -35.52 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.521 0.677 . . . . 0.0 109.959 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 32' ' ' SER . 69.1 m -87.97 179.5 6.42 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.204 171.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.824 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 63.4 m 78.98 -43.39 0.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 122.905 0.482 . . . . 0.0 110.62 -174.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.82 -14.49 63.13 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.782 172.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.5 mtm -98.61 11.61 37.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.586 0.231 . . . . 0.0 110.9 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.12 -2.24 87.9 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.926 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.824 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -98.38 -173.88 2.68 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.683 0.393 . . . . 0.0 110.208 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -149.19 155.32 40.46 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.862 HD13 ' HG ' ' A' ' 27' ' ' SER . 23.1 tp -56.37 131.51 48.47 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.784 ' HE3' HG12 ' A' ' 41' ' ' ILE . 21.4 ttt -50.46 125.78 13.62 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -168.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.401 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 16.9 p -118.18 102.67 9.18 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.377 176.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.784 HG12 ' HE3' ' A' ' 39' ' ' MET . 58.2 mt -73.29 112.67 9.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.646 -177.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.9 t -102.91 -29.68 11.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.513 -177.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.425 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 71.0 p -123.3 151.39 42.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.555 0.693 . . . . 0.0 112.049 -175.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -63.1 -40.2 96.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.102 179.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.405 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.41 -38.58 90.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.589 177.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' A' ' 43' ' ' THR . 88.7 tt0 -54.85 -50.77 67.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.882 175.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.796 HE22 HD13 ' A' ' 104' ' ' LEU . 20.7 tp60 -59.16 -53.87 53.46 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 177.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.257 -175.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.578 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 47.5 m-85 -88.33 -18.66 27.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -175.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.1 tp -82.49 -31.97 10.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.272 -0.571 . . . . 0.0 111.153 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.1 pt -67.9 -9.39 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 30.2 pt20 -86.44 -21.67 26.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.842 0.353 . . . . 0.0 110.561 177.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -89.72 -30.04 18.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.055 0.455 . . . . 0.0 109.934 178.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 52.6 mt -68.84 147.27 51.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.002 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.455 ' HB3' HD22 ' A' ' 58' ' ' LEU . 14.7 t70 -85.09 131.77 34.41 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.7 mtt85 -78.03 14.47 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.314 -170.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 ttm-85 -105.86 -26.31 11.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.783 0.325 . . . . 0.0 110.726 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 55' ' ' ASP . 3.1 mm? -98.51 175.24 6.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.519 0.676 . . . . 0.0 112.119 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.4 m -128.96 122.97 31.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.105 -0.952 . . . . 0.0 108.828 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -108.21 122.88 47.84 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -172.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.442 ' CD2' ' HB1' ' A' ' 122' ' ' ALA . 6.6 m-85 -67.38 140.49 57.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.779 HD11 ' HG ' ' A' ' 104' ' ' LEU . 93.4 mt -121.75 155.81 34.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.234 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.82 44.68 2.81 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.228 -0.51 . . . . 0.0 114.318 -172.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.474 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.7 tp -100.5 115.84 31.05 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -116.91 119.7 36.18 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -167.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.54 154.67 17.14 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 160.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.661 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.9 tt0 -137.74 86.63 2.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.026 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.782 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 2.3 t-20 71.94 36.3 1.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.319 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.34 67.21 0.74 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.672 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 53.0 mttp -94.78 -23.04 17.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.774 178.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.26 -19.93 12.0 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.133 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.418 ' HG2' ' HB3' ' A' ' 70' ' ' LYS . 3.7 pt20 -83.86 92.98 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.319 0.58 . . . . 0.0 110.588 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.611 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 89.9 m95 -65.47 104.99 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.063 177.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -123.18 133.62 54.22 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.509 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 97.0 m95 -73.44 151.47 41.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.9 p -70.42 -5.84 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -172.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.488 ' CG ' ' HG1' ' A' ' 79' ' ' THR . 39.3 p-10 -106.81 10.37 30.76 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 122.224 -0.297 . . . . 0.0 110.207 177.089 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 78' ' ' GLN . 5.2 tt0 81.04 6.36 1.33 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 124.275 0.984 . . . . 0.0 111.436 178.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.509 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 41.3 m -61.46 121.83 66.45 Favored Pre-proline 0 C--O 1.237 0.42 0 CA-C-O 121.008 0.432 . . . . 0.0 110.28 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -63.48 145.4 92.11 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 123.082 2.521 . . . . 0.0 112.544 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.611 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 71.9 t80 -61.52 134.26 56.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.108 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.54 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -95.23 106.71 27.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.275 175.296 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 27.3 Cg_exo -62.96 -24.86 74.04 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.631 2.22 . . . . 0.0 112.486 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -99.21 3.68 46.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.325 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.54 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 76.2 mtt180 -134.82 30.26 3.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.853 0.359 . . . . 0.0 111.32 -177.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.474 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 4.9 p -87.86 98.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.759 0.79 . . . . 0.0 109.552 174.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.38 74.14 10.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.481 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -64.23 156.35 29.04 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 173.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.633 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 24.7 t-80 -67.93 -34.93 77.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.606 -173.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.592 ' HZ1' ' HB3' ' A' ' 90' ' ' LYS . 7.8 ttpm? 176.55 -75.39 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.421 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 28.1 t-20 -135.68 -0.5 2.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.637 0.732 . . . . 0.0 109.423 177.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.497 ' OE1' ' HB3' ' A' ' 90' ' ' LYS . 1.9 mp0 -77.45 115.4 49.14 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.888 -174.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.421 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 2.2 Cg_endo -82.86 -11.18 10.23 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 123.022 2.482 . . . . 0.0 110.527 169.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.57 -161.0 0.22 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.53 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -114.55 6.01 15.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -169.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -88.74 162.35 16.29 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.476 0.655 . . . . 0.0 112.466 -172.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.427 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 90.2 mt-30 -138.99 -157.32 0.76 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.763 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.427 ' O ' ' HB2' ' A' ' 99' ' ' GLU . . . -40.95 129.95 3.33 Favored Glycine 0 C--N 1.336 0.576 0 O-C-N 123.675 0.609 . . . . 0.0 113.894 -177.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.782 ' HG3' ' H ' ' A' ' 68' ' ' ASN . 25.3 mt-10 72.3 61.98 0.13 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 122.245 1.022 . . . . 0.0 109.587 -176.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.766 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.4 p-10 -117.69 154.66 31.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 113.954 -1.476 . . . . 0.0 110.643 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 81.5 m -142.32 127.74 18.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.752 -173.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.647 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 16.8 m -78.9 146.67 7.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.014 0.435 . . . . 0.0 111.239 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 m -125.51 148.44 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.565 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.796 HD13 HE22 ' A' ' 47' ' ' GLN . 5.9 mt -83.88 106.13 15.32 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.4 p -128.54 139.61 51.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.847 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -83.42 97.35 8.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.771 174.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -137.75 139.46 40.11 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.688 -174.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 58.23 49.84 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.4 p30 53.05 18.91 1.23 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.551 1.14 . . . . 0.0 113.394 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.437 ' HB3' ' NZ ' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -145.69 144.93 30.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.477 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.408 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.0 m95 -79.22 127.74 32.43 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.74 172.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.633 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -167.94 173.86 7.86 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.269 0.356 . . . . 0.0 110.259 174.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.647 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.4 m0 -84.17 119.02 24.52 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.998 0.428 . . . . 0.0 111.135 -176.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -105.76 132.39 51.94 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 166.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.766 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 8.4 t70 -85.99 123.79 31.71 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.746 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 42.1 t -132.31 140.61 38.5 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -43.19 127.91 5.48 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.92 2.413 . . . . 0.0 111.668 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 5.8 m -69.65 -6.94 34.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.529 -172.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -96.61 9.64 40.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.425 ' O ' ' HA ' ' A' ' 23' ' ' THR . 80.9 t80 -86.31 132.21 34.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.038 176.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.483 ' OE2' HG22 ' A' ' 23' ' ' THR . 8.6 mm-40 -80.11 116.6 20.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.284 175.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.442 ' HB1' ' CD2' ' A' ' 61' ' ' PHE . . . -142.79 -168.97 2.9 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.531 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.435 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 27.0 m -82.66 171.43 14.03 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.414 ' CZ ' HD12 ' A' ' 18' ' ' LEU . 14.9 ptt180 -148.79 161.82 41.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.574 HG23 ' SD ' ' A' ' 39' ' ' MET . 4.4 mm -123.75 133.27 69.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.172 172.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 94.7 m -118.82 134.24 55.29 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.362 0.601 . . . . 0.0 110.328 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -112.18 135.95 52.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 -172.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.5 tt -139.06 142.45 33.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -64.52 166.96 16.09 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.306 2.004 . . . . 0.0 111.605 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.474 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -61.83 89.9 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.52 173.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.1 p -72.18 9.22 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 t -70.46 -15.32 62.8 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.82 -20.04 39.88 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.036 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -88.95 -46.99 8.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.228 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.8 26.11 2.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.886 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.435 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.19 -48.93 79.25 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -174.713 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.435 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 19.2 t-20 -73.93 -30.28 62.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 0.0 110.397 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.88 -45.11 90.87 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -74.63 -21.54 59.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.734 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -70.85 -34.67 71.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.056 0.455 . . . . 0.0 110.241 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -86.7 -6.25 58.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.747 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.211 -175.842 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.592 ' HB2' HG21 ' A' ' 131' ' ' THR . 62.9 mtt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.9 m -142.78 138.56 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.152 0.282 . . . . 0.0 110.562 178.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.89 121.93 39.48 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.45 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 83.3 Cg_exo -48.37 143.98 14.24 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.063 2.509 . . . . 0.0 112.728 -177.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 27.9 pt -71.69 -11.56 15.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.34 -172.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.66 -18.95 39.24 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.572 ' HH2' ' HG3' ' A' ' 34' ' ' MET . 16.2 m0 -66.32 162.81 19.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.526 177.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.7 tpp180 -90.3 110.87 21.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.992 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.696 ' HB3' HD21 ' A' ' 133' ' ' LEU . . . -93.26 121.42 34.61 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.555 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 88.0 t80 -136.45 133.97 37.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.955 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.437 ' HG3' ' CE2' ' A' ' 10' ' ' PHE . 48.1 mt-30 57.48 -94.77 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.688 0.618 . . . . 0.0 110.77 -174.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.0 p -141.03 27.72 1.95 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -131.57 160.41 35.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.715 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HB2' HG21 ' A' ' 128' ' ' ILE . 7.8 m -117.59 127.36 53.89 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.555 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 22.4 m-85 -117.3 145.83 43.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.55 -174.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.499 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 5.8 t80 -136.41 115.2 10.68 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.305 176.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 4.8 Cg_endo -88.19 117.39 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.385 2.723 . . . . 0.0 111.828 177.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.583 ' HG ' ' NH2' ' A' ' 124' ' ' ARG . 3.5 mm? -95.23 142.13 28.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.422 -178.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 p -110.58 4.51 20.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -81.67 168.51 18.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.354 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.431 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 3.1 p-10 -104.37 129.54 52.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.751 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.578 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 14.4 mmmm -156.17 141.32 17.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.632 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 34.6 p -57.35 160.98 3.61 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 173.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.495 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 52.9 t90 -56.6 -44.13 80.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -55.23 -47.38 75.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.408 177.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.578 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 38.5 mm-40 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.698 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.434 ' OG ' ' HG2' ' A' ' 124' ' ' ARG . 49.5 m -59.25 -48.0 83.26 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.715 0.293 . . . . 0.0 110.66 173.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 36.0 tt0 -56.83 -44.16 81.79 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.797 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 78.0 mtt180 -75.54 -35.11 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.595 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -72.14 -28.72 63.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.442 -170.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 32' ' ' SER . 18.6 m -97.97 127.03 43.66 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 166.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.602 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 58.3 p 166.13 -60.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.303 0.377 . . . . 0.0 110.448 -174.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.08 -25.38 59.69 Favored Glycine 0 C--N 1.331 0.283 0 CA-C-N 115.384 -0.826 . . . . 0.0 113.36 -176.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.572 ' HG3' ' HH2' ' A' ' 7' ' ' TRP . 0.9 OUTLIER -86.56 15.46 5.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.8 0.333 . . . . 0.0 110.591 178.409 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.22 23.3 63.57 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.602 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -124.62 -179.09 4.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.361 0.6 . . . . 0.0 111.822 -172.495 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -137.16 169.12 18.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 30.4 tp -60.96 128.38 36.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 168.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.946 ' HE2' HD12 ' A' ' 41' ' ' ILE . 24.6 ttt -47.35 112.26 0.51 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -167.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 p -93.0 110.54 22.01 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.242 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.946 HD12 ' HE2' ' A' ' 39' ' ' MET . 16.5 mm -55.12 106.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 109.523 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -88.47 -38.37 15.06 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.627 -174.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.408 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 16.3 p -137.8 154.68 49.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.061 0.458 . . . . 0.0 110.866 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.93 -32.93 74.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.841 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -74.01 -34.69 64.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.729 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 43' ' ' THR . 37.0 tt0 -54.98 -50.16 69.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.109 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.691 HE21 HD22 ' A' ' 104' ' ' LEU . 40.4 tt0 -63.02 -47.32 83.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.736 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.841 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.8 p30 -68.43 -28.13 66.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.772 0.32 . . . . 0.0 111.356 -174.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -88.54 -17.78 29.52 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.504 HG21 ' HE1' ' A' ' 39' ' ' MET . 10.2 tp -87.45 -28.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 118.679 0.672 . . . . 0.0 111.09 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.688 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.7 pt -69.9 -11.16 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -87.29 -18.32 30.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.734 0.302 . . . . 0.0 110.672 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -91.65 -22.09 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 109.658 177.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 90.8 mt -74.91 145.33 42.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.458 178.211 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.612 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 12.2 t70 -74.72 117.4 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.485 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 43.2 mtt180 -68.98 57.95 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.471 0.482 . . . . 0.0 111.759 -178.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 2.9 ttp180 -158.2 -33.5 0.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.407 HD22 ' HB3' ' A' ' 55' ' ' ASP . 2.9 mm? -92.53 167.64 11.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.386 0.612 . . . . 0.0 111.672 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.589 ' HB3' HG23 ' A' ' 103' ' ' VAL . 1.4 m -112.88 118.87 36.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.847 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.471 ' O ' HG22 ' A' ' 103' ' ' VAL . 92.4 m-85 -107.84 121.03 43.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.235 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.511 ' CE2' ' HB1' ' A' ' 122' ' ' ALA . 26.7 m-85 -71.97 144.96 48.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.693 0.283 . . . . 0.0 111.149 177.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.641 ' CD2' ' HG ' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -133.2 176.59 8.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 174.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.484 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -79.74 62.51 4.14 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 115.067 0.787 . . . . 0.0 115.067 -167.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.641 HD22 HD11 ' A' ' 62' ' ' LEU . 3.5 mm? -115.12 104.61 12.03 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 166.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HB2' HG13 ' A' ' 76' ' ' VAL . 3.3 ttm-85 -93.82 116.91 29.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.197 0.522 . . . . 0.0 111.925 -169.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.666 ' HB3' ' HB2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -134.13 85.77 2.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.381 175.505 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.72 31.28 0.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.978 0.894 . . . . 0.0 108.817 176.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.857 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 3.6 t-20 179.05 137.17 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -168.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.51 87.51 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 120.946 0.403 . . . . 0.0 110.152 170.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.857 ' HZ3' ' HB3' ' A' ' 68' ' ' ASN . 2.2 ptpp? -126.33 118.91 26.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.821 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.01 54.03 2.19 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.969 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.557 ' HG2' ' HB2' ' A' ' 70' ' ' LYS . 9.8 pt20 -154.26 44.68 0.55 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.678 ' CH2' ' HB3' ' A' ' 100' ' ' ASN . 77.4 m95 -37.11 117.0 0.49 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.5 1.125 . . . . 0.0 112.449 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -117.39 156.89 27.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.068 0.461 . . . . 0.0 111.097 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.484 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 42.1 m95 -86.84 153.37 21.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.674 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.514 HG13 ' HB2' ' A' ' 65' ' ' ARG . 34.7 m -73.33 -6.94 8.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -173.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -129.54 81.75 2.04 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.369 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.475 HE21 ' N ' ' A' ' 79' ' ' THR . 0.0 OUTLIER 68.29 -56.45 0.5 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.273 1.029 . . . . 0.0 113.117 175.077 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.481 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 18.2 m -44.23 120.16 3.64 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 79' ' ' THR . 33.1 Cg_endo -66.91 169.64 14.42 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.361 2.708 . . . . 0.0 111.957 170.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -54.25 137.62 40.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.721 -177.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -91.09 108.23 26.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.08 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.84 -24.02 25.21 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 113.071 -176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -95.4 -27.39 15.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.778 0.323 . . . . 0.0 111.361 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -112.4 83.72 1.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.167 0.508 . . . . 0.0 111.487 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 t -124.22 100.92 8.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.14 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -98.28 92.34 5.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.677 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -96.09 173.79 7.24 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.505 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 79.8 m-70 -83.62 -48.44 10.2 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.081 176.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -155.48 -41.03 0.08 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.968 171.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -171.37 65.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.496 ' OE1' ' HB2' ' A' ' 89' ' ' HIS . 22.9 mp0 -123.93 77.55 58.16 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.724 -178.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -94.94 -149.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.106 2.537 . . . . 0.0 111.877 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.41 120.91 3.09 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.763 0.664 . . . . 0.0 110.552 174.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.44 ' HB3' ' CG ' ' A' ' 115' ' ' ASP . 3.3 t30 -133.81 -50.04 0.83 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.521 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.6 t -80.9 82.45 6.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.069 0.461 . . . . 0.0 109.939 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -61.86 102.12 0.25 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.96 0.886 . . . . 0.0 111.963 -174.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 154.54 -59.42 0.39 Allowed Glycine 0 C--N 1.314 -0.683 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 -179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.574 ' OE2' ' HB2' ' A' ' 118' ' ' CYS . 41.6 mt-10 -105.12 -148.81 0.41 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.678 ' HB3' ' CH2' ' A' ' 73' ' ' TRP . 5.1 m-20 -165.64 -91.85 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 169.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.699 ' HB2' ' O ' ' A' ' 116' ' ' VAL . 2.3 m 66.8 116.46 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 O-C-N 124.01 0.819 . . . . 0.0 111.6 168.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.621 HG12 ' CH2' ' A' ' 73' ' ' TRP . 4.7 m -107.16 144.98 15.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.645 0.736 . . . . 0.0 112.694 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.589 HG23 ' HB3' ' A' ' 59' ' ' SER . 2.2 p -111.43 148.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.394 175.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.691 HD22 HE21 ' A' ' 47' ' ' GLN . 12.0 mt -82.29 101.65 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 164.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.21 150.21 25.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 -175.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -81.35 115.16 20.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.061 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.505 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 40.2 t30 -162.1 129.85 3.99 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.455 ' C ' ' H ' ' A' ' 110' ' ' LYS . 18.3 mt-30 69.09 35.9 2.61 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -173.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.5 t70 71.31 -25.46 0.17 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.802 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.455 ' H ' ' C ' ' A' ' 108' ' ' GLN . 21.3 pttm -101.2 146.75 27.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.504 0.669 . . . . 0.0 111.15 -173.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.688 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 69.3 m95 -81.91 130.86 35.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.423 172.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -156.17 167.17 31.26 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.558 ' HA ' ' O ' ' A' ' 103' ' ' VAL . 42.0 m0 -71.74 143.59 49.56 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.667 0.605 . . . . 0.0 110.78 -176.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.466 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 3.9 t30 -140.52 147.47 39.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.39 174.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.44 ' CG ' ' HB3' ' A' ' 95' ' ' ASN . 5.3 t70 -66.92 124.64 23.56 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.387 0.429 . . . . 0.0 111.039 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.699 ' O ' ' HB2' ' A' ' 101' ' ' CYS . 3.5 m -154.89 116.46 2.42 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.694 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.17 147.59 8.1 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.8 2.333 . . . . 0.0 112.777 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.586 ' O ' ' HB ' ' A' ' 23' ' ' THR . 33.5 m -70.22 -11.52 60.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.65 0.262 . . . . 0.0 111.023 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -89.97 6.61 41.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.632 ' O ' ' HA ' ' A' ' 23' ' ' THR . 79.0 t80 -93.99 133.26 37.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.476 ' OE2' HG23 ' A' ' 23' ' ' THR . 7.8 mm-40 -83.67 134.24 34.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.047 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.511 ' HB1' ' CE2' ' A' ' 61' ' ' PHE . . . -159.47 -170.2 2.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.351 174.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 30.0 m -81.0 164.82 22.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.793 -177.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.583 ' NH2' ' HG ' ' A' ' 18' ' ' LEU . 42.1 mtm105 -127.86 161.72 28.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.137 0.494 . . . . 0.0 111.913 -170.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 19.5 mt -134.3 125.25 47.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 57.7 m -102.66 129.69 49.33 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.608 ' HB3' ' HA ' ' A' ' 39' ' ' MET . 1.1 tppp? -114.85 122.55 46.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.007 0.432 . . . . 0.0 110.838 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.609 HG21 ' HB2' ' A' ' 14' ' ' CYS . 8.3 tt -129.34 140.94 40.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.024 174.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.436 ' HD2' HG13 ' A' ' 128' ' ' ILE . 19.7 Cg_endo -59.16 153.26 53.79 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.265 1.976 . . . . 0.0 111.914 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -74.35 57.81 2.41 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.073 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 1' ' ' MET . 2.9 t -60.3 -35.32 75.31 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 122.736 0.415 . . . . 0.0 111.132 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.4 p -94.85 2.16 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.957 0.408 . . . . 0.0 111.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.696 HD21 ' HB3' ' A' ' 9' ' ' ALA . 10.5 mp -90.16 -31.38 17.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -87.29 -55.63 3.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.178 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 139' ' ' TYR . . . -90.14 40.06 0.99 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.436 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.417 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.61 -50.2 72.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -175.069 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.417 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 17.9 t-20 -80.1 -31.15 39.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.226 0.536 . . . . 0.0 110.285 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -61.24 -44.41 97.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.281 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 135' ' ' ALA . 0.2 OUTLIER -76.09 -25.09 55.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.989 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -67.47 -31.2 71.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -86.92 -5.43 59.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.123 -177.263 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.442 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.485 1.279 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.436 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 18.9 m -138.14 162.89 30.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.474 ' SG ' ' HA2' ' A' ' 130' ' ' GLY . 13.3 m -113.88 93.06 27.65 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-O 121.01 0.433 . . . . 0.0 110.216 -179.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.509 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 4.6 Cg_endo -86.51 163.02 9.53 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.554 2.836 . . . . 0.0 113.881 -176.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.1 mt 56.88 -98.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.572 171.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -118.93 15.46 13.38 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.523 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 79.0 m95 -68.63 105.09 2.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.537 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 30.3 mmt180 -73.35 114.46 11.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.896 -173.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.76 121.73 28.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.766 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.435 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 87.5 t80 -129.93 102.67 6.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.878 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 66.76 -70.7 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.568 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -142.35 -11.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.119 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -100.33 159.06 15.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.9 0.381 . . . . 0.0 111.487 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 73.4 m -133.69 127.95 33.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.668 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.462 ' OH ' ' HG3' ' A' ' 46' ' ' GLU . 13.2 m-85 -121.37 137.75 54.56 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.738 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.523 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 33.4 t80 -124.26 114.93 27.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.711 0.291 . . . . 0.0 110.357 176.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 19.2 Cg_endo -89.53 128.13 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 123.346 2.698 . . . . 0.0 112.429 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.557 HD22 ' NH2' ' A' ' 124' ' ' ARG . 4.1 mp -119.36 139.18 52.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.5 p -107.76 19.97 19.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -93.17 138.31 31.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.92 0.39 . . . . 0.0 110.867 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -56.38 115.56 2.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.719 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.707 ' HB2' ' HZ2' ' A' ' 22' ' ' LYS . 0.3 OUTLIER -156.11 141.1 17.27 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.904 0.383 . . . . 0.0 110.896 -174.142 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.42 ' OG1' ' HG3' ' A' ' 26' ' ' GLU . 77.7 p -81.65 158.46 24.29 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.475 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 54.6 t90 -57.17 -45.05 84.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.917 0.389 . . . . 0.0 110.634 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.17 91.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.177 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.543 ' HG2' ' NH1' ' A' ' 29' ' ' ARG . 47.3 mt-10 -72.46 -35.41 68.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.221 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.605 ' HB3' ' HD3' ' A' ' 124' ' ' ARG . 67.3 m -52.3 -51.28 59.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.03 175.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' CD ' ' HD1' ' A' ' 37' ' ' HIS . 9.8 tp10 -76.69 -21.08 55.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.605 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.543 ' NH1' ' HG2' ' A' ' 26' ' ' GLU . 53.1 ttp180 -68.4 -37.41 80.33 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.079 0.466 . . . . 0.0 110.762 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -81.15 -37.27 29.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.519 0.676 . . . . 0.0 110.035 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 32' ' ' SER . 86.6 m -85.47 179.91 7.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.631 175.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.675 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 27.6 t 79.62 -43.65 0.29 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 122.715 0.406 . . . . 0.0 110.643 -177.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.94 -20.07 64.11 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.325 175.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.3 mtm -92.15 9.22 34.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 0.0 110.343 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.13 51.03 7.11 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -172.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.675 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -144.56 -178.35 5.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.936 0.398 . . . . 0.0 111.446 -170.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.405 ' HD1' ' CD ' ' A' ' 28' ' ' GLU . 2.9 m-70 -159.46 166.84 30.1 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 169.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.92 158.4 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.589 174.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.409 ' HG2' ' HB ' ' A' ' 125' ' ' ILE . 65.3 mmm -46.51 104.19 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -174.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.467 HG22 ' CE3' ' A' ' 75' ' ' TRP . 18.9 p -98.72 93.28 6.0 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.498 0.665 . . . . 0.0 109.388 169.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.4 HG12 ' HE3' ' A' ' 39' ' ' MET . 64.5 mt -76.01 122.47 30.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.158 -173.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.0 m -107.86 -27.29 10.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.874 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.1 p -134.53 155.74 49.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.619 0.723 . . . . 0.0 112.241 -176.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -65.67 -37.96 87.96 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.623 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.695 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -69.33 -37.85 77.91 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.462 ' HG3' ' OH ' ' A' ' 15' ' ' TYR . 67.1 tt0 -53.72 -50.62 65.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.584 0.707 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.449 ' NE2' HD11 ' A' ' 51' ' ' ILE . 1.0 OUTLIER -64.14 -48.67 75.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.008 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.695 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.0 OUTLIER -68.12 -27.27 66.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.025 -175.529 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.596 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 3.2 m-85 -80.6 -32.48 36.41 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 178.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.552 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 8.9 tp -78.51 -30.47 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.509 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 40.9 pt -71.17 -9.69 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 11.1 pt20 -87.48 -13.44 43.14 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.382 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.63 -23.6 17.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.2 0.524 . . . . 0.0 109.639 174.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.9 mt -74.31 150.17 40.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.594 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.429 ' OD2' ' HD3' ' A' ' 57' ' ' ARG . 45.1 t0 -80.43 127.43 32.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.641 178.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.582 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 75.1 mtt180 -80.28 30.17 0.28 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -167.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.555 ' HG2' HD12 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -139.38 -1.2 1.72 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.779 169.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.555 HD12 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mp -100.74 157.7 16.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.13 0.49 . . . . 0.0 111.397 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.601 ' HB3' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -109.81 117.3 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.427 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.659 ' HB3' HG13 ' A' ' 125' ' ' ILE . 83.6 m-85 -108.77 121.46 45.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.522 0.201 . . . . 0.0 111.201 -176.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -64.99 141.82 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.186 0.517 . . . . 0.0 112.103 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.631 HD11 ' HG ' ' A' ' 104' ' ' LEU . 65.0 mt -107.06 158.73 16.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.152 175.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.58 49.98 4.15 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.217 -174.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.61 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 40.2 tp -131.59 124.07 29.24 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.8 ptm85 -133.99 154.37 51.16 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.748 0.785 . . . . 0.0 112.493 -174.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -112.17 152.52 28.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.216 -1.356 . . . . 0.0 107.359 166.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB3' ' HD2' ' A' ' 70' ' ' LYS . 4.2 tp10 -109.41 104.56 13.67 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.881 -172.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 11.2 m120 72.26 -66.74 0.29 Allowed 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.745 0.653 . . . . 0.0 110.798 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -179.82 80.26 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 123.75 0.82 . . . . 0.0 108.828 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.597 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 17.1 mtpp -101.51 -61.6 1.36 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.329 -174.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 115.53 -21.84 12.44 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.597 ' OE1' ' HB3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -113.96 107.23 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.687 0.756 . . . . 0.0 110.309 177.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.61 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 25.7 m95 -76.15 150.9 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.951 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 143.52 46.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 176.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.467 ' CE3' HG22 ' A' ' 40' ' ' THR . 98.7 m95 -74.98 161.72 29.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.7 p -75.96 -6.57 8.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.384 0.611 . . . . 0.0 111.396 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 15.4 p30 -109.0 21.24 17.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.284 175.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.448 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 57.8 tp60 79.29 -8.18 1.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.146 174.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 36.1 m -58.84 124.34 72.87 Favored Pre-proline 0 C--N 1.323 -0.569 0 O-C-N 122.06 -0.4 . . . . 0.0 110.525 177.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -62.54 149.57 90.58 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.534 2.156 . . . . 0.0 111.763 175.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.453 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 76.2 t80 -59.92 122.63 14.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.0 111.756 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.465 ' ND2' ' HB3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -82.19 106.76 7.0 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.49 174.349 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -63.7 -53.27 1.39 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.085 2.523 . . . . 0.0 112.484 -176.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -89.83 34.41 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.975 0.416 . . . . 0.0 111.305 -177.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.465 ' HB3' ' ND2' ' A' ' 82' ' ' ASN . 12.2 tpt180 -140.43 21.73 2.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.215 0.531 . . . . 0.0 109.623 176.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.527 HG22 ' CE3' ' A' ' 113' ' ' TRP . 11.0 p -107.04 148.8 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.11 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -129.0 74.74 1.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.25 -0.18 . . . . 0.0 110.692 -177.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.69 174.25 5.29 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.023 0.439 . . . . 0.0 111.102 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.64 ' CE1' ' HB2' ' A' ' 107' ' ' ASN . 54.5 m-70 -83.8 -60.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.688 0.28 . . . . 0.0 110.854 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -131.07 -68.74 0.66 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.752 0.786 . . . . 0.0 109.707 -175.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 p30 179.65 52.49 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.395 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.466 ' HA ' ' HD3' ' A' ' 93' ' ' PRO . 1.2 mp0 -46.85 114.15 2.68 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.85 -172.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 2.9 Cg_exo -76.26 177.91 8.17 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 123.496 2.797 . . . . 0.0 112.942 -175.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -73.37 90.45 1.67 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.405 178.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -111.31 -39.62 4.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.156 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.532 ' HB2' ' ND2' ' A' ' 100' ' ' ASN . 4.2 m -85.27 117.49 24.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.918 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -123.74 88.04 2.84 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 146.53 89.69 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 10.1 pt-20 43.17 92.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.409 1.084 . . . . 0.0 111.837 -174.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.532 ' ND2' ' HB2' ' A' ' 96' ' ' SER . 2.1 m-20 -86.02 139.48 31.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.312 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 56.2 m -136.15 143.27 44.4 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.941 0.401 . . . . 0.0 109.981 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.525 HG12 ' HB2' ' A' ' 62' ' ' LEU . 12.1 p -95.04 145.06 8.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.256 0.55 . . . . 0.0 111.841 -171.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.601 HG21 ' HB3' ' A' ' 59' ' ' SER . 1.0 OUTLIER -126.95 142.5 43.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.353 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.631 ' HG ' HD11 ' A' ' 62' ' ' LEU . 11.3 mt -83.64 109.44 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 167.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.43 148.28 31.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.609 -176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.582 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 10.2 t80 -87.75 96.09 10.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.095 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.64 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 14.2 m120 -131.48 144.04 50.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 65.89 24.73 11.23 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.62 0.575 . . . . 0.0 109.634 -176.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.64 22.94 12.73 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.833 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -137.08 148.3 46.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.025 0.44 . . . . 0.0 110.65 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.509 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 81.5 m95 -79.66 124.38 28.5 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.468 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -158.27 167.19 30.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.898 0.38 . . . . 0.0 111.096 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.527 ' CE3' HG22 ' A' ' 86' ' ' VAL . 7.6 m0 -78.55 138.75 38.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.969 -176.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -134.64 144.82 48.08 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -86.27 124.86 33.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.866 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.6 m -141.26 158.78 63.32 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.41 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.492 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 14.2 Cg_endo -58.1 133.17 53.72 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.406 2.071 . . . . 0.0 111.011 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 24' ' ' TRP . 3.8 t -72.52 -16.99 61.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.992 0.425 . . . . 0.0 111.245 -173.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -89.95 4.6 49.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.009 0.433 . . . . 0.0 110.185 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.492 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 63.3 t80 -81.2 151.01 28.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -102.93 142.34 34.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.23 0.538 . . . . 0.0 110.995 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.91 -167.62 1.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.26 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 26.4 m -78.91 170.99 15.82 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.141 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.605 ' HD3' ' HB3' ' A' ' 27' ' ' SER . 4.2 ttp180 -144.84 145.57 31.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -168.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.659 HG13 ' HB3' ' A' ' 60' ' ' TYR . 9.6 mt -128.4 125.29 63.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 89.8 m -113.04 146.58 38.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.037 0.446 . . . . 0.0 110.512 177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -121.12 132.92 55.15 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.304 -170.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.479 ' CG1' ' HB2' ' A' ' 36' ' ' ALA . 29.3 mt -128.59 141.06 40.27 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.979 176.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.566 ' HB2' HG22 ' A' ' 131' ' ' THR . 13.4 Cg_exo -65.87 133.59 34.29 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.325 1.35 . . . . 0.0 110.251 169.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.474 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -48.24 -55.93 9.84 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 121.224 -0.512 . . . . 0.0 112.105 -177.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.566 HG22 ' HB2' ' A' ' 129' ' ' PRO . 48.0 p 61.93 -31.76 0.08 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.078 1.351 . . . . 0.0 113.849 176.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 130' ' ' GLY . 10.3 t -63.12 -21.83 66.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.462 0.305 . . . . 0.0 111.045 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.527 ' H ' HD21 ' A' ' 133' ' ' LEU . 2.8 mm? -56.37 -21.23 23.44 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.627 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -87.39 -41.68 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.101 0.477 . . . . 0.0 110.195 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.79 16.95 8.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.271 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -55.49 -52.43 63.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.002 0.429 . . . . 0.0 111.246 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -73.77 -27.66 61.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.476 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -63.2 -47.99 80.22 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.637 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 53.2 t80 -75.12 -24.31 58.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.332 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -65.79 -26.56 67.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.347 0.594 . . . . 0.0 109.979 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -83.71 -32.79 25.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.423 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' SER . . . . . 0.637 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 96.7 p . . . . . 0 C--O 1.252 1.23 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.577 -170.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.69 ' HG3' ' HA ' ' A' ' 12' ' ' SER . 77.2 mtm . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -69.57 119.57 15.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.433 -178.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.451 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 76.2 m -147.16 171.04 6.81 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.537 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 66.2 Cg_exo -53.07 154.15 14.24 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.356 2.037 . . . . 0.0 112.417 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.6 tp -70.47 -17.39 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.092 -171.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -83.16 -23.85 32.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.863 0.363 . . . . 0.0 110.841 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.537 ' HD1' ' HB2' ' A' ' 4' ' ' PRO . 37.2 m95 -82.1 154.86 25.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.027 0.442 . . . . 0.0 110.258 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 34.9 mmt-85 -108.61 118.13 35.97 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.119 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.46 133.05 35.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.974 -174.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.446 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.1 t80 -129.15 102.24 6.38 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 58.31 -97.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.777 -176.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.69 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 9.9 p -93.63 -38.43 11.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.92 -178.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -82.56 168.45 17.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.537 -172.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 72.0 m -146.71 129.46 16.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.579 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.506 ' CE2' ' HE3' ' A' ' 127' ' ' LYS . 5.0 m-85 -120.93 141.91 50.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.578 0.228 . . . . 0.0 110.994 -173.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 47.4 t80 -128.69 118.23 19.85 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.018 176.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -84.69 120.16 2.34 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.672 2.248 . . . . 0.0 112.07 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.605 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.1 mp -109.08 139.83 43.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.996 0.427 . . . . 0.0 110.188 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.9 p -106.3 13.37 28.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.479 -177.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.531 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 12.4 p-10 -79.35 126.24 30.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.553 ' HB2' ' HB3' ' A' ' 121' ' ' GLU . 5.4 p-10 -70.59 104.45 2.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.73 0.776 . . . . 0.0 110.692 -177.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.454 ' HZ2' ' CD ' ' A' ' 26' ' ' GLU . 64.3 mmtt -135.71 156.71 48.4 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.217 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.0 p -77.67 171.55 14.77 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.371 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -60.07 -40.25 88.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.194 0.521 . . . . 0.0 109.996 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.7 -48.77 75.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.244 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.662 ' HG2' HH11 ' A' ' 29' ' ' ARG . 19.7 mt-10 -68.2 -34.97 77.25 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.283 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.414 ' HB3' HD12 ' A' ' 38' ' ' LEU . 67.9 m -53.17 -50.46 64.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.008 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.515 ' HG2' HD11 ' A' ' 38' ' ' LEU . 9.5 mm-40 -72.1 -22.23 61.38 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.724 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.662 HH11 ' HG2' ' A' ' 26' ' ' GLU . 51.1 mtp180 -69.03 -35.53 76.74 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.767 0.318 . . . . 0.0 111.273 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -80.51 -28.52 37.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.556 0.693 . . . . 0.0 109.747 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 93.4 m -85.42 178.61 7.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.473 173.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 t 74.96 -50.65 0.67 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.819 0.447 . . . . 0.0 110.954 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.15 -25.12 69.37 Favored Glycine 0 C--O 1.227 -0.293 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.151 178.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.3 mtm -91.89 6.08 47.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.579 0.228 . . . . 0.0 110.619 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.33 -1.18 87.98 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.64 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.558 ' HB1' ' HB ' ' A' ' 128' ' ' ILE . . . -96.82 -176.75 3.67 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.708 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.17 163.1 40.01 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 176.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.515 HD11 ' HG2' ' A' ' 28' ' ' GLU . 5.2 mp -56.16 144.66 28.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.04 0.448 . . . . 0.0 111.528 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.626 ' HE2' HG12 ' A' ' 41' ' ' ILE . 14.2 tpt -53.43 113.37 1.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.656 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 38.6 p -104.62 135.95 45.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.059 171.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.626 HG12 ' HE2' ' A' ' 39' ' ' MET . 36.8 mt -105.61 116.79 50.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.159 0.504 . . . . 0.0 110.716 -178.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -97.63 -40.58 8.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.233 -178.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.6 p -135.02 167.23 21.32 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.2 0.524 . . . . 0.0 111.378 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -70.66 -34.71 72.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.845 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.437 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -64.08 -46.62 83.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.384 178.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -54.98 -47.77 74.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.092 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.423 ' O ' HG22 ' A' ' 51' ' ' ILE . 35.0 tt0 -59.79 -56.37 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.044 176.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.426 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 12.6 m-80 -53.82 -42.19 68.15 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.197 -176.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.437 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 22.6 m-85 -67.19 -44.9 78.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.2 tp -75.52 -32.14 24.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.828 -174.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.566 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.1 pt -70.45 -7.09 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 110.981 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.1 mt-30 -87.13 -23.13 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.678 174.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -89.28 -21.49 23.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.093 0.473 . . . . 0.0 110.156 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 71.2 mt -78.05 145.03 36.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.126 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.418 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.8 t70 -77.65 127.85 33.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.552 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.1 mtt180 -75.86 24.67 0.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -171.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.8 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.9 ptp180 -124.38 -15.75 6.58 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.075 175.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.8 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.4 mm? -95.7 161.99 13.8 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.278 0.561 . . . . 0.0 111.624 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.5 m -118.29 117.08 28.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.225 175.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.706 ' HB3' HG13 ' A' ' 125' ' ' ILE . 87.0 m-85 -102.09 124.86 48.43 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -169.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.476 ' HA ' HG11 ' A' ' 103' ' ' VAL . 8.2 m-85 -58.85 135.73 57.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.843 0.354 . . . . 0.0 111.812 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.428 HD12 ' HB2' ' A' ' 104' ' ' LEU . 68.0 mt -115.85 175.0 5.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.272 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.61 -15.91 80.96 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.918 -0.658 . . . . 0.0 114.176 -174.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.568 ' HB3' HG23 ' A' ' 102' ' ' VAL . 47.6 tp -71.08 120.26 16.4 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.956 0.878 . . . . 0.0 110.88 -172.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -116.79 137.82 51.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.956 -174.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 6.6 t70 -113.21 139.02 49.13 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 158.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.589 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 26.0 tt0 -114.34 92.38 3.94 Favored 'General case' 0 C--N 1.31 -1.118 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.435 -173.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.489 ' HA ' ' H ' ' A' ' 99' ' ' GLU . 0.2 OUTLIER 76.09 -63.79 0.38 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 124.311 1.007 . . . . 0.0 110.001 -176.145 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 179.3 77.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.424 1.078 . . . . 0.0 108.69 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 51.8 mttp -121.76 125.94 47.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.767 -176.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.54 54.55 3.68 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.301 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -154.4 66.14 0.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.363 0.602 . . . . 0.0 110.182 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.54 ' HB3' HD13 ' A' ' 64' ' ' LEU . 91.1 m95 -57.78 128.77 38.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.707 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.721 ' HD3' ' HA ' ' A' ' 78' ' ' GLN . 13.3 ttm180 -137.93 149.63 46.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.338 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.597 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 95.6 m95 -80.33 109.24 14.62 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 171.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 77' ' ' ASP . 2.8 p 28.25 -72.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 175.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.421 ' N ' ' O ' ' A' ' 75' ' ' TRP . 0.5 OUTLIER -78.85 -86.75 0.07 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 0.0 111.56 -173.41 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.721 ' HA ' ' HD3' ' A' ' 74' ' ' ARG . 21.6 tp60 -145.99 -1.72 0.75 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.1 0.476 . . . . 0.0 109.87 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.597 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 71.4 m -60.46 117.48 24.95 Favored Pre-proline 0 N--CA 1.452 -0.367 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.384 178.302 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 28.5 Cg_exo -63.85 147.11 92.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.177 2.585 . . . . 0.0 112.978 -176.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.39 147.01 52.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.472 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -83.6 124.7 75.07 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.304 -177.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.71 -2.66 12.9 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.651 2.234 . . . . 0.0 113.86 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.625 ' HA ' ' NE ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -130.39 -34.53 1.6 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.79 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -83.47 82.53 8.25 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.969 0.414 . . . . 0.0 110.016 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.87 111.0 28.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.762 -178.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -121.09 91.88 3.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.022 -175.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -99.68 -178.44 3.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 110.98 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.663 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 72.9 m-70 -123.53 137.57 54.74 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.574 172.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.05 12.87 3.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.855 0.836 . . . . 0.0 110.269 176.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.412 ' H ' ' C ' ' A' ' 89' ' ' HIS . 13.4 m120 -112.31 37.78 2.92 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.324 -1.307 . . . . 0.0 109.738 175.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -61.95 147.02 90.74 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.871 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.31 167.69 26.23 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.793 2.329 . . . . 0.0 112.76 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.26 -56.7 17.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.086 -179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -144.01 113.76 7.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.919 -178.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.8 p -113.08 19.17 17.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.191 0.519 . . . . 0.0 110.327 175.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -73.6 135.12 43.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.169 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.82 88.13 2.0 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -175.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.489 ' H ' ' HA ' ' A' ' 68' ' ' ASN . 1.1 mp0 44.45 84.61 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.256 0.623 . . . . 0.0 111.962 -170.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.549 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 35.1 t30 -97.23 118.62 34.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.6 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 59.2 m -120.85 132.92 55.27 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.575 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 15.5 m -88.8 141.85 13.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.291 0.567 . . . . 0.0 111.035 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.476 HG11 ' HA ' ' A' ' 61' ' ' PHE . 27.8 m -115.67 152.65 17.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.82 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.428 ' HB2' HD12 ' A' ' 62' ' ' LEU . 16.7 tp -83.55 101.85 11.74 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 174.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p -118.68 142.51 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.283 0.563 . . . . 0.0 111.283 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.431 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 88.2 t80 -77.86 117.89 19.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.47 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.663 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 22.7 t-20 -151.48 116.38 5.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.467 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.42 ' C ' ' H ' ' A' ' 110' ' ' LYS . 50.0 mt-30 66.03 46.65 2.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.402 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 74.31 -25.45 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.371 1.044 . . . . 0.0 112.231 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 108' ' ' GLN . 12.3 pttm -106.22 146.04 30.8 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.457 0.646 . . . . 0.0 111.45 -174.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.566 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 61.5 m95 -91.73 136.36 33.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.193 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.452 ' HB1' ' CE1' ' A' ' 89' ' ' HIS . . . -156.04 171.33 20.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.575 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 6.9 m0 -77.84 138.7 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.302 0.377 . . . . 0.0 110.451 -175.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -130.37 129.88 43.67 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.47 124.4 23.47 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.572 0.545 . . . . 0.0 111.417 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.4 m -146.41 157.72 48.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.86 138.46 85.85 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.026 1.817 . . . . 0.0 111.467 174.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.5 m -62.76 -20.1 64.63 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.14 0.495 . . . . 0.0 110.356 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -98.12 80.65 2.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.729 0.776 . . . . 0.0 109.11 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -155.26 110.09 2.98 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.434 -1.257 . . . . 0.0 108.232 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 21' ' ' ASN . 5.6 mp0 -63.28 110.27 1.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.102 0.477 . . . . 0.0 111.224 -175.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -140.35 -174.03 3.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.553 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.6 p -83.15 171.61 13.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.605 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -147.92 147.98 30.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.909 0.385 . . . . 0.0 111.906 -170.623 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.706 HG13 ' HB3' ' A' ' 60' ' ' TYR . 43.7 mt -117.43 131.76 69.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.3 t -117.54 133.8 55.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . 0.506 ' HE3' ' CE2' ' A' ' 15' ' ' TYR . 21.3 ptmt -123.2 139.91 53.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.973 0.416 . . . . 0.0 110.39 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.558 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 10.9 tt -131.42 140.44 38.45 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 163.76 36.81 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.668 1.578 . . . . 0.0 110.749 170.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.532 ' HA3' ' HB2' ' A' ' 1' ' ' MET . . . -72.04 59.66 1.41 Allowed Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.967 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.2 t -96.52 14.76 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 23.3 m -57.7 -32.4 67.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.658 ' H ' HD13 ' A' ' 133' ' ' LEU . 2.9 mp -71.18 -43.36 67.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.162 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -67.2 -26.31 66.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.468 0.652 . . . . 0.0 110.244 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.28 25.22 1.96 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.317 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 9.2 pt-20 -54.5 -51.43 65.12 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.712 0.291 . . . . 0.0 111.401 -178.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.452 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 0.2 OUTLIER -74.13 -32.25 63.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -178.907 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.37 -46.77 88.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -69.42 -29.31 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.509 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -67.46 -23.8 65.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.706 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 27.7 mt-30 -86.72 -5.57 59.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.642 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.909 -177.566 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.5 p -159.67 155.93 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 13.8 p -150.01 170.63 7.4 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' A' ' 3' ' ' CYS . 79.4 Cg_exo -48.89 139.88 24.5 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.542 2.161 . . . . 0.0 112.313 176.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tt -72.37 89.19 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 121.946 0.879 . . . . 0.0 110.741 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -172.81 -52.48 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.283 -1.326 . . . . 0.0 108.101 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -75.19 128.42 35.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.098 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -74.33 104.22 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.15 0.5 . . . . 0.0 110.686 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.469 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . . . -70.55 134.44 47.67 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.959 177.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.406 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 74.9 t80 -144.49 124.7 13.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.573 178.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 64.0 -82.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.353 0.661 . . . . 0.0 111.392 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.0 m -146.19 6.99 1.02 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -120.77 166.67 13.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 69.9 m -122.61 126.93 48.69 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 32.6 m-85 -120.15 117.05 26.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.456 -174.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -111.66 115.64 51.15 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 0.0 110.703 178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -85.79 122.41 2.29 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.294 2.662 . . . . 0.0 112.203 177.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.91 138.4 41.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.752 0.31 . . . . 0.0 110.342 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.4 p -89.03 -4.28 58.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.32 0.581 . . . . 0.0 109.907 174.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.434 ' CG ' ' HZ2' ' A' ' 22' ' ' LYS . 7.1 t70 -66.2 139.97 58.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.919 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -97.28 123.69 41.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.58 -174.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.434 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 5.9 mttp -155.54 158.81 39.06 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.958 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.616 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 72.6 p -70.74 167.16 19.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 174.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.713 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.6 t90 -61.07 -35.19 76.3 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.001 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.469 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -63.62 -52.23 61.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.71 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.1 -40.5 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.524 ' HB3' HD11 ' A' ' 38' ' ' LEU . 47.6 m -58.05 -40.38 80.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.288 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.433 ' HA ' HD21 ' A' ' 38' ' ' LEU . 43.9 tt0 -74.03 -26.22 60.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.12 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.4 mtm180 -79.03 -45.1 20.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.09 0.471 . . . . 0.0 110.961 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.1 -37.87 88.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.722 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.5 m -85.57 178.9 7.23 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 171.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.52 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 24.9 m 76.85 -47.19 0.52 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.903 0.481 . . . . 0.0 111.138 -178.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.53 -20.19 67.61 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.109 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.4 mtm -93.15 6.73 46.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.699 0.285 . . . . 0.0 110.573 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.1 -5.93 69.48 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.725 -175.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.52 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -96.42 179.43 5.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.458 -0.371 . . . . 0.0 110.701 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.573 ' HB3' HG13 ' A' ' 76' ' ' VAL . 97.3 m-70 -147.45 169.57 19.24 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 27' ' ' SER . 3.9 mm? -59.05 154.72 15.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.865 0.302 . . . . 0.0 111.283 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.935 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.7 tpt -49.77 108.47 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.458 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.583 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 70.3 p -108.15 108.04 18.93 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.283 0.563 . . . . 0.0 110.246 177.067 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.528 HG12 ' HE2' ' A' ' 39' ' ' MET . 60.9 mt -73.42 103.09 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.453 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.4 m -77.99 -48.7 15.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.06 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 55.5 p -125.42 170.15 11.67 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.85 0.833 . . . . 0.0 111.871 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -61.82 -25.84 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.55 -41.68 72.15 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.285 177.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' A' ' 43' ' ' THR . 1.9 mp0 -48.25 -54.88 12.06 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.209 0.528 . . . . 0.0 109.588 171.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.769 HE22 HD11 ' A' ' 51' ' ' ILE . 0.8 OUTLIER -55.31 -59.97 4.06 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.623 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -58.55 -40.51 83.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -173.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -84.44 -36.39 22.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.602 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.25 -33.36 57.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.824 -176.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.769 HD11 HE22 ' A' ' 47' ' ' GLN . 43.0 pt -69.99 -10.33 13.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -76.01 -33.99 59.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.926 0.394 . . . . 0.0 110.0 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.89 -25.65 24.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.552 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.602 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 80.6 mt -67.94 140.2 56.43 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.662 -178.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.516 ' HB3' HD21 ' A' ' 58' ' ' LEU . 11.3 t70 -77.4 128.84 34.95 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.58 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 82.5 mtt180 -81.04 7.42 10.88 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -167.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.892 ' HG2' HD23 ' A' ' 58' ' ' LEU . 5.0 ptp180 -103.8 -13.5 16.4 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.01 176.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.892 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -101.52 150.29 23.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.059 0.457 . . . . 0.0 110.912 179.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.1 m -107.15 124.52 49.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.616 ' HB3' HG13 ' A' ' 125' ' ' ILE . 88.6 m-85 -105.89 122.38 46.0 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -172.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.75 ' HA ' HG12 ' A' ' 103' ' ' VAL . 21.5 m-85 -59.92 140.63 56.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.633 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.565 HD21 ' HG ' ' A' ' 104' ' ' LEU . 82.4 mt -107.68 168.22 9.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.397 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -92.84 25.48 19.15 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.148 -177.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.659 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 38.7 tp -92.87 109.03 20.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.429 ' HE ' ' HH2' ' A' ' 24' ' ' TRP . 13.2 ttm180 -96.34 122.07 38.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -173.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -104.59 154.26 20.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 157.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 68' ' ' ASN . 27.8 tt0 -135.24 95.82 3.37 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.284 -174.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.739 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 18.5 m120 78.7 -45.29 0.38 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.188 175.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 68' ' ' ASN . . . 165.14 -6.34 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.981 -171.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 35.1 mttp -68.09 94.03 0.47 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 172.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -69.0 72.56 0.39 Allowed Glycine 0 C--N 1.329 0.162 0 O-C-N 123.649 0.593 . . . . 0.0 113.266 -176.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -125.22 74.45 1.38 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.659 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 92.1 m95 -68.19 104.88 1.93 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.303 -175.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -134.15 152.34 51.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.164 177.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.583 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 85.5 m95 -85.88 147.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 120.256 -0.578 . . . . 0.0 109.599 177.499 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.573 HG13 ' HB3' ' A' ' 37' ' ' HIS . 11.3 p -77.53 -6.76 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -167.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.557 ' CG ' ' HG1' ' A' ' 40' ' ' THR . 22.9 p-10 -100.69 -60.05 1.59 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 121.334 -0.854 . . . . 0.0 111.214 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -170.24 -21.57 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.172 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.437 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.3 m -60.33 122.07 64.48 Favored Pre-proline 0 C--O 1.24 0.592 0 CA-C-O 121.569 0.699 . . . . 0.0 111.811 -172.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.9 Cg_exo -71.12 157.31 57.91 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.223 2.615 . . . . 0.0 111.312 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -71.89 126.14 28.98 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.466 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.496 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 19.7 m-80 -96.24 106.38 28.42 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.417 179.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.03 -29.45 40.31 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.517 2.144 . . . . 0.0 112.211 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -78.98 -22.89 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.736 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 73.0 mtt180 -117.97 31.34 6.75 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.246 -171.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 86' ' ' VAL . 7.1 p -88.78 91.6 3.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 122.116 0.96 . . . . 0.0 109.661 175.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.01 68.12 9.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.366 -169.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.428 ' CD1' HG22 ' A' ' 86' ' ' VAL . 79.0 m95 -74.23 143.8 44.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 172.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.567 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 83.6 m-70 -66.32 171.33 4.92 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 171.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.617 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -107.21 59.21 0.62 Allowed 'General case' 0 CA--C 1.5 -0.952 0 CA-C-O 122.758 1.266 . . . . 0.0 111.534 -176.353 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.43 ' HB2' ' OE1' ' A' ' 92' ' ' GLU . 2.6 m-80 -155.05 -53.67 0.09 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 111.843 -2.435 . . . . 0.0 108.316 175.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.515 ' HB3' HD22 ' A' ' 95' ' ' ASN . 1.9 mp0 -82.18 118.47 72.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 114.482 -1.236 . . . . 0.0 112.151 -173.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -93.66 -65.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.446 2.764 . . . . 0.0 110.666 165.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -146.94 126.75 13.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.58 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.515 HD22 ' HB3' ' A' ' 92' ' ' GLU . 44.1 m-80 -102.3 -30.77 10.88 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.63 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.4 m -159.63 92.3 1.03 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -174.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.763 HE21 ' HA ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -77.57 85.0 3.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.56 0.695 . . . . 0.0 109.909 167.834 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.739 ' O ' ' HA ' ' A' ' 68' ' ' ASN . . . -125.32 -55.36 0.17 Allowed Glycine 0 CA--C 1.507 -0.459 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 176.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.566 ' HA ' ' H ' ' A' ' 68' ' ' ASN . 0.0 OUTLIER -133.48 -43.22 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 161.267 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.8 t30 69.53 123.44 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 166.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -154.83 160.7 41.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 173.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.433 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.3 m -107.65 148.02 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.17 0.509 . . . . 0.0 112.171 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.75 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -125.74 156.69 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.563 175.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.565 ' HG ' HD21 ' A' ' 62' ' ' LEU . 15.4 mt -86.53 118.39 25.92 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.3 p -134.81 143.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.601 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -80.56 105.72 12.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.754 179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.42 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 48.1 t30 -156.81 140.03 15.57 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.155 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.431 ' O ' ' HB3' ' A' ' 109' ' ' ASP . 41.9 mt-30 67.34 40.7 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.831 0.707 . . . . 0.0 109.688 -175.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' A' ' 108' ' ' GLN . 31.2 t70 78.82 -16.22 0.69 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.493 174.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.547 ' HZ1' ' HB2' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -135.75 170.79 15.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.477 0.656 . . . . 0.0 112.213 -174.299 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.58 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 72.2 m95 -88.07 130.63 34.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.539 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.567 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -153.04 171.1 18.91 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -78.01 131.88 37.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.554 0.534 . . . . 0.0 110.807 -173.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -121.17 127.95 52.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.087 174.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -82.8 125.69 31.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.254 0.549 . . . . 0.0 110.59 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.9 m -141.33 155.23 67.78 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.159 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.89 133.12 53.88 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.18 1.92 . . . . 0.0 111.246 172.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.713 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 66.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.181 -178.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -77.24 -7.77 56.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.427 . . . . 0.0 110.651 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -83.59 140.98 31.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -104.52 145.21 30.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.223 0.535 . . . . 0.0 111.33 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -159.8 -168.78 2.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.353 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.3 m -78.39 170.82 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.448 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 12.9 ptt180 -152.17 148.07 27.18 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.944 -171.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.935 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.3 mt -113.23 135.26 53.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.5 t -114.31 130.78 56.67 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -115.54 131.94 56.78 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.655 -175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.46 ' HB ' ' HB3' ' A' ' 36' ' ' ALA . 11.2 tt -127.54 138.5 32.96 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 175.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -64.48 166.32 17.79 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.048 1.832 . . . . 0.0 111.042 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -70.13 82.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.924 177.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 17.0 p -76.36 18.53 0.3 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 122.818 0.447 . . . . 0.0 111.797 -177.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.424 ' H ' ' C ' ' A' ' 130' ' ' GLY . 9.4 t -65.36 -14.41 60.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.106 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -69.69 -29.48 66.91 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.505 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . 0.404 HD21 ' C ' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -73.48 -38.9 65.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.97 28.2 1.64 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.967 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 7.8 pt-20 -52.31 -51.65 57.43 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.374 0.421 . . . . 0.0 112.005 -175.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.426 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 28.7 p-10 -80.5 -27.53 37.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.653 0.264 . . . . 0.0 110.895 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.2 -49.78 70.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -73.54 -22.32 60.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -67.69 -33.1 74.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.084 0.469 . . . . 0.0 110.061 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.6 mt-30 -88.14 -6.17 58.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.413 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.026 -175.339 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.595 ' HG3' ' HA3' ' A' ' 130' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.567 ' HB ' ' CG2' ' A' ' 132' ' ' THR . 60.4 t -73.23 116.97 16.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.8 m -152.27 168.87 10.47 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -177.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.13 147.36 54.55 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.016 1.811 . . . . 0.0 111.258 172.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.14 -24.93 34.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 121.182 0.515 . . . . 0.0 110.966 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -59.7 -58.22 9.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.418 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 33.4 m95 -64.71 138.7 58.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.212 176.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.494 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 1.7 tpp180 -86.0 106.88 17.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.092 0.472 . . . . 0.0 110.743 -176.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.25 122.54 26.44 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.38 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.444 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 65.7 t80 -140.14 119.04 12.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 56.76 -129.6 1.78 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.111 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -88.4 -4.94 58.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.706 0.289 . . . . 0.0 111.138 -178.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -105.67 169.17 8.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.136 0.493 . . . . 0.0 111.524 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.5 m -139.6 135.54 33.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.149 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.444 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 17.4 m-85 -124.43 129.64 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.932 -172.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 40.3 t80 -116.46 114.16 40.48 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.398 175.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.2 Cg_endo -88.77 130.97 2.27 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.334 2.689 . . . . 0.0 112.4 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.545 ' O ' ' HB3' ' A' ' 123' ' ' SER . 5.8 mp -107.63 140.5 40.56 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.52 60.2 1.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.398 0.618 . . . . 0.0 112.121 -171.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.455 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 1.3 t70 82.44 -168.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.292 165.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 65.1 27.44 12.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.099 -178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -141.81 141.44 33.15 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.347 0.594 . . . . 0.0 110.962 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 p -91.94 166.2 12.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.058 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.658 ' CH2' ' HG3' ' A' ' 65' ' ' ARG . 58.7 t90 -64.91 -34.78 79.22 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.3 -177.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.58 -51.88 68.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.34 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.67 -43.49 93.97 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.185 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.508 ' HB3' HD12 ' A' ' 38' ' ' LEU . 69.0 m -55.01 -46.92 75.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.468 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -68.91 -26.05 64.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.942 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -83.66 -30.24 26.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.815 0.341 . . . . 0.0 110.989 178.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.59 -42.68 19.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.569 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.4 m -101.26 128.67 47.28 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 p 154.31 -65.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.668 1.23 . . . . 0.0 108.78 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.52 -19.37 72.75 Favored Glycine 0 C--O 1.227 -0.295 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.917 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.8 mtm -78.53 1.06 23.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.751 0.31 . . . . 0.0 110.564 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.82 -11.88 63.22 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.684 ' HB1' ' HB ' ' A' ' 128' ' ' ILE . . . -96.49 161.98 13.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.576 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.432 ' HB3' HG21 ' A' ' 76' ' ' VAL . 28.3 m-70 -130.25 170.41 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.508 HD12 ' HB3' ' A' ' 27' ' ' SER . 4.5 mm? -56.89 148.44 20.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 173.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.762 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -46.65 106.64 0.09 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.833 0.708 . . . . 0.0 112.57 -174.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.522 HG23 ' CE3' ' A' ' 75' ' ' TRP . 24.3 p -105.9 89.08 2.97 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.182 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.746 HG12 ' HE2' ' A' ' 39' ' ' MET . 30.1 mt -65.69 110.85 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 110.26 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.6 m -102.34 -30.8 10.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.941 -175.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 32.0 p -131.61 155.25 47.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.461 0.648 . . . . 0.0 112.309 -177.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -62.35 -46.78 87.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.988 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.5 -39.2 79.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.51 ' HB3' ' O ' ' A' ' 43' ' ' THR . 84.1 tt0 -52.46 -57.25 10.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.673 176.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -61.04 -50.91 71.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.928 179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -57.22 -31.34 65.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -88.28 -36.53 16.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.588 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.1 tp -73.1 -30.25 31.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.836 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.586 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.2 pt -71.67 -4.53 4.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.063 0.459 . . . . 0.0 110.997 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -87.85 -27.26 22.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.932 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -87.91 -22.97 24.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.642 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.588 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 73.7 mt -70.54 149.93 46.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.86 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -57.73 -28.34 63.79 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.928 -177.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.639 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 60.0 mtt180 64.5 20.35 12.12 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.668 0.747 . . . . 0.0 109.273 -168.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.3 ttp180 -120.69 -21.7 6.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.076 -176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -117.85 169.99 9.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.7 p -107.43 122.1 45.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.257 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -104.67 120.51 41.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 -172.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.435 ' HZ ' ' O ' ' A' ' 120' ' ' PHE . 44.7 m-85 -55.19 136.97 48.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.021 0.439 . . . . 0.0 111.851 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.6 HD22 ' HB2' ' A' ' 104' ' ' LEU . 78.0 mt -108.21 -175.07 2.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.276 177.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.435 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -96.07 11.35 67.64 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.965 -174.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.541 ' HB3' HG22 ' A' ' 102' ' ' VAL . 28.7 tp -80.05 119.44 22.88 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.658 ' HG3' ' CH2' ' A' ' 24' ' ' TRP . 31.1 ttt-85 -111.81 126.25 54.88 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -133.75 149.95 51.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.428 -0.805 . . . . 0.0 108.945 164.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 2.4 pt-20 -148.46 119.96 7.95 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.007 0.432 . . . . 0.0 110.477 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 58.01 33.97 23.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.613 176.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.576 ' N ' ' HA2' ' A' ' 98' ' ' GLY . . . 67.99 80.79 0.2 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.744 0.653 . . . . 0.0 112.023 175.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 58.0 mttp -129.03 113.03 14.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.663 175.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.5 59.74 1.2 Allowed Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.088 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -137.59 70.28 1.4 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -61.13 108.66 0.93 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.966 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 74' ' ' ARG . 55.1 mtm-85 -141.38 172.41 12.72 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.522 ' CE3' HG23 ' A' ' 40' ' ' THR . 97.4 m95 -86.11 173.29 9.95 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 174.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.432 HG21 ' HB3' ' A' ' 37' ' ' HIS . 19.6 m -78.33 39.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 111.265 179.304 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 11.3 t70 -164.74 -160.16 0.49 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.466 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 22.4 tp60 -78.67 -6.44 55.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.413 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 3.5 m -74.0 120.85 83.39 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.834 -177.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 3.4 Cg_exo -78.34 155.59 28.78 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.946 2.431 . . . . 0.0 111.651 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.86 133.15 51.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.935 0.397 . . . . 0.0 110.368 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.611 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -101.44 115.55 64.88 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.67 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.88 -9.59 25.34 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.695 2.263 . . . . 0.0 112.319 177.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 84' ' ' ARG . 6.1 tpp180 -110.1 1.52 18.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.161 0.505 . . . . 0.0 110.238 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.611 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 20.2 mmt180 -128.77 57.29 1.62 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.346 0.593 . . . . 0.0 110.048 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.2 p -138.25 139.67 41.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.609 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -127.51 76.4 1.67 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.716 0.293 . . . . 0.0 110.565 -177.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -67.97 -176.05 0.64 Allowed 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.655 0.741 . . . . 0.0 112.439 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.511 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 1.2 m-70 -101.64 -154.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.478 -178.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.628 ' HB2' HE22 ' A' ' 108' ' ' GLN . 72.9 mmtt -129.24 9.14 5.62 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.694 0.759 . . . . 0.0 109.369 172.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -164.25 81.63 0.41 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.321 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -109.87 142.93 26.87 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.393 175.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.24 158.05 20.02 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.89 2.393 . . . . 0.0 113.28 -176.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -101.92 -2.66 29.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.759 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.13 -44.8 83.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.185 -172.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.431 ' HB2' ' ND2' ' A' ' 100' ' ' ASN . 0.0 OUTLIER -77.07 119.85 21.34 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.461 . . . . 0.0 111.471 -176.422 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -136.38 88.12 2.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.302 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.576 ' HA2' ' N ' ' A' ' 69' ' ' ALA . . . 123.36 111.56 2.02 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 110.606 -0.997 . . . . 0.0 110.606 -173.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.5 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 97.7 mt-10 73.07 50.05 0.15 Allowed 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -174.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 96' ' ' SER . 12.1 m120 -86.51 106.12 17.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.455 178.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.7 m -119.87 123.25 43.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.045 0.45 . . . . 0.0 110.398 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.541 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.2 m -80.77 135.6 24.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.068 0.461 . . . . 0.0 110.526 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.7 m -115.39 147.57 18.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.826 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.6 ' HB2' HD22 ' A' ' 62' ' ' LEU . 28.0 tp -83.16 101.73 11.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 175.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.3 p -121.83 145.58 28.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 -174.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.427 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 29.7 t80 -86.08 99.41 11.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.538 177.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.511 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.3 t-20 -149.48 137.28 20.33 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.628 HE22 ' HB2' ' A' ' 90' ' ' LYS . 92.2 mt-30 69.83 24.71 5.21 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -171.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.2 t70 71.18 -11.3 0.69 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.098 -1.41 . . . . 0.0 111.637 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.417 ' H ' ' C ' ' A' ' 108' ' ' GLN . 14.5 ptmm? -109.04 150.67 27.45 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.0 110.304 -178.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.639 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 95.1 m95 -77.42 130.83 37.58 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -152.47 156.41 39.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.823 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.537 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 17.8 m0 -81.14 115.31 20.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.37 -178.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -107.03 133.88 51.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -77.89 124.09 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.257 0.348 . . . . 0.0 111.07 -179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.428 HG22 ' CE1' ' A' ' 120' ' ' PHE . 3.3 m -149.56 158.52 37.71 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.974 176.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.5 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 17.7 Cg_endo -60.89 137.32 71.66 Favored 'Trans proline' 0 CA--C 1.531 0.338 0 C-N-CA 122.282 1.988 . . . . 0.0 111.787 175.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.529 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 41.8 m -64.67 -23.85 67.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.39 15.14 18.42 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.023 -0.423 . . . . 0.0 111.169 -174.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 122' ' ' ALA . 0.1 OUTLIER -84.55 140.42 31.43 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.91 128.45 35.54 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.788 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 120' ' ' PHE . . . -161.87 -169.24 2.16 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.242 0.544 . . . . 0.0 111.261 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.545 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 14.5 m -96.6 -176.58 3.65 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.615 177.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.44 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 13.9 ptt-85 -165.41 170.08 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.045 0.45 . . . . 0.0 111.35 177.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.762 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.0 mt -122.35 135.73 61.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 6.1 t -103.43 129.16 50.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -111.95 113.08 25.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.823 -171.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.684 ' HB ' ' HB1' ' A' ' 36' ' ' ALA . 11.5 tt -124.85 138.78 32.04 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-O 120.867 0.365 . . . . 0.0 110.883 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -70.08 167.54 24.58 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 123.15 2.567 . . . . 0.0 111.99 170.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.595 ' HA3' ' HG3' ' A' ' 1' ' ' MET . . . -64.56 93.37 0.14 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.715 174.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.3 p -78.21 33.22 0.19 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.567 ' CG2' ' HB ' ' A' ' 2' ' ' VAL . 21.4 p -67.36 -17.13 64.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.996 0.427 . . . . 0.0 110.837 176.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 78.9 mt -73.38 -18.14 61.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.568 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -88.67 -56.52 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 110.071 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.58 29.05 1.36 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.297 -175.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -63.12 -55.81 22.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -175.788 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.473 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 5.3 p30 -80.86 -22.84 39.54 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.31 -39.48 93.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.394 177.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -81.6 -30.78 32.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.31 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -67.73 -31.2 70.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.755 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -86.76 -5.41 59.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.74 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.36 -175.657 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.482 ' HG3' ' HA ' ' A' ' 12' ' ' SER . 72.2 mtm . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.558 ' HB ' HD12 ' A' ' 133' ' ' LEU . 58.5 t -90.38 118.81 36.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.502 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 65.3 m -151.12 173.95 3.95 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.502 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 51.9 Cg_exo -53.83 148.53 37.03 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.057 1.838 . . . . 0.0 111.453 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.82 -29.93 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.925 0.393 . . . . 0.0 111.356 -172.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.09 -29.91 71.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.692 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 23.6 m95 -88.26 125.83 34.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.583 -174.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 8' ' ' ARG . 16.6 tpt180 -73.6 99.86 3.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.195 0.522 . . . . 0.0 110.063 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.37 129.46 39.83 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.86 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 85.9 t80 -132.69 105.79 7.39 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.426 177.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 56.96 -103.57 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.786 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.482 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 30.2 t -91.25 -37.94 12.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.626 -177.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -92.65 174.33 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.136 0.493 . . . . 0.0 111.729 -173.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HB2' HG23 ' A' ' 128' ' ' ILE . 78.2 m -141.2 127.5 19.79 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.407 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.455 ' HH ' ' HG3' ' A' ' 46' ' ' GLU . 53.7 m-85 -120.58 127.25 51.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.386 -171.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.8 t80 -117.94 114.66 37.17 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.781 0.324 . . . . 0.0 110.408 176.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 5.2 Cg_endo -88.11 128.01 2.22 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.247 2.631 . . . . 0.0 112.075 176.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.05 138.57 48.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.009 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 p -89.43 2.69 54.14 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.527 0.68 . . . . 0.0 109.408 173.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 22' ' ' LYS . 3.9 t70 -66.48 133.52 50.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.002 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.686 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 16.5 p-10 -93.09 107.03 18.91 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.849 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.897 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 14.4 mptt -136.83 156.08 48.96 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.833 177.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.488 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 76.4 p -76.46 167.57 21.61 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.64 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.5 t90 -58.89 -39.2 80.73 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.941 0.4 . . . . 0.0 110.771 -176.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.09 76.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.186 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.97 -34.48 77.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.044 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.613 ' HG ' HD13 ' A' ' 38' ' ' LEU . 25.9 t -58.45 -46.33 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.866 178.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -74.9 -22.46 58.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.76 0.314 . . . . 0.0 110.39 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -67.66 -45.81 74.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.782 0.325 . . . . 0.0 110.744 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.408 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.7 t-20 -71.97 -28.7 63.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.201 0.524 . . . . 0.0 109.949 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 65.3 m -84.13 177.13 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 33.2 t 75.33 -34.82 0.26 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.017 0.527 . . . . 0.0 110.919 -177.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' H ' ' C ' ' A' ' 31' ' ' CYS . . . -61.67 -29.27 71.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.97 175.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.508 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.5 pmm? -100.47 10.51 41.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.331 . . . . 0.0 110.368 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.75 19.82 67.17 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.524 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.605 ' HB1' HG12 ' A' ' 128' ' ' ILE . . . -113.79 172.77 6.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.658 0.266 . . . . 0.0 111.39 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.465 ' HD2' ' OD1' ' A' ' 77' ' ' ASP . 71.3 m-70 -140.48 169.2 18.11 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.613 HD13 ' HG ' ' A' ' 27' ' ' SER . 4.1 mm? -52.44 141.02 20.86 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.371 0.419 . . . . 0.0 110.922 173.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.82 ' HE3' HG12 ' A' ' 41' ' ' ILE . 15.8 tpt -36.26 111.15 0.13 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.145 0.903 . . . . 0.0 112.439 177.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.595 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 12.0 p -111.89 89.01 2.94 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.522 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.82 HG12 ' HE3' ' A' ' 39' ' ' MET . 41.9 mt -64.65 114.83 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.486 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m -106.9 -22.78 12.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.832 -177.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.585 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 13.1 p -132.96 151.9 52.0 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.362 1.077 . . . . 0.0 113.182 -178.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.96 -50.63 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.548 -179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.426 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -59.36 -39.41 83.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.542 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.585 ' HB3' ' O ' ' A' ' 43' ' ' THR . 61.8 tt0 -48.5 -58.93 3.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.183 176.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.496 ' HA ' HG22 ' A' ' 50' ' ' ILE . 23.0 tt0 -61.18 -44.66 96.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.932 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -61.96 -25.42 67.6 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -177.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.426 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 27.5 m-85 -88.53 -37.81 15.42 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.3 tp -71.88 -30.01 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 120.381 -0.528 . . . . 0.0 111.103 -176.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.452 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.8 pt -69.44 -5.79 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.032 0.444 . . . . 0.0 111.196 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -87.22 -25.29 24.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.211 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -92.97 -23.81 18.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.494 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.7 mt -76.55 144.43 39.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.043 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.524 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -78.65 138.2 38.19 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.561 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 84.8 mtt180 -83.46 11.68 6.63 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -170.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.821 ' HG2' HD22 ' A' ' 58' ' ' LEU . 7.3 ptp180 -112.11 -11.08 13.84 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.755 176.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.821 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -100.22 166.91 10.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.271 0.558 . . . . 0.0 111.609 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.3 m -127.17 124.09 38.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.035 175.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.69 ' HB3' HG13 ' A' ' 125' ' ' ILE . 80.6 m-85 -109.07 121.95 46.23 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -169.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.439 ' HA ' HG11 ' A' ' 103' ' ' VAL . 19.1 m-85 -62.38 138.94 58.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.725 0.297 . . . . 0.0 111.791 177.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.612 HD23 HG11 ' A' ' 102' ' ' VAL . 1.4 mm? -110.92 173.36 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 174.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.621 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -87.73 60.65 4.19 Favored Glycine 0 C--O 1.225 -0.414 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.315 -177.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.457 HD23 ' HB ' ' A' ' 102' ' ' VAL . 3.3 mm? -109.55 126.42 53.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.724 0.262 . . . . 0.0 110.329 177.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' NH1' ' HB3' ' A' ' 67' ' ' GLU . 16.5 ttp85 -110.87 117.53 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.422 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -136.49 84.85 2.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.982 0.896 . . . . 0.0 108.998 164.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.597 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 3.3 tm-20 -91.15 123.82 34.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.499 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.548 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 3.2 t-20 71.28 19.94 5.19 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.867 0.73 . . . . 0.0 110.191 178.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.37 75.14 0.33 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.127 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.597 ' HZ1' ' CD ' ' A' ' 67' ' ' GLU . 52.0 mttp -101.95 -22.56 14.27 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.654 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 -8.17 62.79 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.568 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -86.07 65.14 8.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.554 0.692 . . . . 0.0 110.289 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -61.16 113.82 2.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.177 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -133.32 151.01 51.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.737 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.621 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 75.4 m95 -84.61 136.96 33.55 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.432 HG21 ' CZ2' ' A' ' 24' ' ' TRP . 10.5 t -79.2 47.98 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.662 0.744 . . . . 0.0 110.809 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.592 ' HB3' HG22 ' A' ' 40' ' ' THR . 33.9 t70 -162.09 32.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -178.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.76 -37.29 0.28 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.279 -1.328 . . . . 0.0 111.586 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.569 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 24.2 m -43.26 122.29 3.27 Favored Pre-proline 0 C--O 1.239 0.505 0 CA-C-O 121.531 0.681 . . . . 0.0 112.664 -176.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.8 Cg_exo -72.04 148.15 50.27 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 123.309 2.673 . . . . 0.0 111.644 174.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -69.86 127.91 34.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.253 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.471 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 0.9 OUTLIER -89.65 115.98 65.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.347 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.65 -29.15 36.73 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.63 2.22 . . . . 0.0 112.651 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -90.09 -22.56 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.802 0.334 . . . . 0.0 111.249 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.471 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 86.4 mtt180 -105.92 76.91 1.21 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.512 0.673 . . . . 0.0 110.484 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.0 p -136.41 131.02 47.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.944 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -126.39 52.05 1.76 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.909 -168.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.41 ' CH2' HG21 ' A' ' 102' ' ' VAL . 85.8 m95 -64.81 177.95 0.87 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.454 0.645 . . . . 0.0 111.372 178.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.478 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 91.0 m-70 -79.3 126.54 30.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.536 172.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.671 ' HD3' ' H ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -58.55 108.48 0.64 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.572 0.701 . . . . 0.0 109.648 174.733 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 61.05 90.13 0.07 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.784 -167.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.46 ' HG3' ' HB2' ' A' ' 89' ' ' HIS . 28.6 tt0 -101.61 105.14 39.0 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.18 -172.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -82.06 -24.98 3.63 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.468 2.112 . . . . 0.0 111.101 172.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -86.92 83.34 7.54 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.077 176.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -148.22 144.57 27.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.079 -177.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 m -121.44 163.71 18.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.821 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -135.66 124.75 24.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.352 175.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 134.75 -101.7 0.41 Allowed Glycine 0 N--CA 1.453 -0.197 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 37.4 mt-10 -88.95 66.69 7.97 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.471 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.2 p-10 -103.64 132.06 50.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.529 0.68 . . . . 0.0 111.891 -170.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.37 166.34 28.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.464 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.612 HG11 HD23 ' A' ' 62' ' ' LEU . 59.1 t -95.71 139.88 18.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -169.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.439 HG11 ' HA ' ' A' ' 61' ' ' PHE . 32.6 m -123.9 141.45 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.718 168.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.51 ' N ' HD21 ' A' ' 62' ' ' LEU . 13.9 tp -81.53 109.99 16.5 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.38 140.46 49.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.57 -172.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.561 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 66.5 t80 -88.25 96.09 10.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.478 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 49.5 t-20 -129.33 128.53 43.31 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -176.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 61.45 38.79 15.67 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.856 0.722 . . . . 0.0 109.987 -175.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 10.5 m-20 65.56 16.9 10.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.246 -1.343 . . . . 0.0 113.15 174.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.433 ' HE2' ' HB2' ' A' ' 110' ' ' LYS . 10.9 ptmm? -132.49 137.09 47.08 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.903 172.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.452 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -70.8 130.35 41.46 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 170.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -157.0 168.81 26.38 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.471 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.403 ' HB3' HG12 ' A' ' 102' ' ' VAL . 37.0 m0 -79.15 142.16 36.61 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.292 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -136.25 122.17 20.04 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 13.5 t70 -84.17 123.6 30.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.702 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.448 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 21.3 m -139.23 159.94 64.27 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.458 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.521 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 13.1 Cg_endo -57.38 131.32 44.04 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.53 2.153 . . . . 0.0 111.942 175.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 69.5 m -67.19 -12.75 60.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.19 0.519 . . . . 0.0 110.657 177.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -85.77 -2.78 58.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.55 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.45 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 83.5 t80 -88.0 138.35 31.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.109 175.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.96 135.91 33.73 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.906 0.384 . . . . 0.0 110.252 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.418 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -154.14 -173.21 4.49 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.969 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 39.2 m -74.29 160.45 31.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.985 0.421 . . . . 0.0 110.088 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.897 ' HD2' ' HB2' ' A' ' 22' ' ' LYS . 48.4 mtp180 -127.26 145.85 50.63 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.587 -169.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.69 HG13 ' HB3' ' A' ' 60' ' ' TYR . 59.0 mt -124.65 119.63 56.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 166.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . 0.475 ' SG ' ' HB2' ' A' ' 36' ' ' ALA . 3.8 t -108.54 132.8 53.47 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -112.91 126.54 55.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.075 0.464 . . . . 0.0 111.961 -174.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.605 HG12 ' HB1' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -111.38 134.74 21.09 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.941 175.562 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.437 ' HD2' HD11 ' A' ' 128' ' ' ILE . 6.6 Cg_exo -74.11 158.63 45.35 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.113 1.875 . . . . 0.0 111.164 173.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.41 49.59 2.33 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.9 t -111.12 18.08 19.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.08 0.467 . . . . 0.0 110.521 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.2 m -60.53 -21.91 63.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.227 0.536 . . . . 0.0 111.258 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.558 HD12 ' HB ' ' A' ' 2' ' ' VAL . 3.9 mp -75.91 -28.9 58.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.102 179.121 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -87.82 -43.17 12.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.871 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . 0.521 ' HB2' ' HB3' ' A' ' 138' ' ' LEU . . . -85.79 61.13 6.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.172 -177.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -43.37 74.2 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.2 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -74.8 -30.08 61.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.521 ' HB3' ' HB2' ' A' ' 135' ' ' ALA . 3.1 tt -64.91 -45.28 86.53 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.82 -30.55 71.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.278 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -71.95 -35.64 69.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.812 178.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -86.64 -6.11 58.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.998 -176.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.252 1.226 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.785 -177.618 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ptt? . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 88.3 t -74.92 112.98 13.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-O 121.104 0.478 . . . . 0.0 111.386 -172.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.762 ' SG ' ' HD2' ' A' ' 4' ' ' PRO . 3.0 t -170.46 166.06 5.12 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 173.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.762 ' HD2' ' SG ' ' A' ' 3' ' ' CYS . 18.5 Cg_endo -64.96 119.42 6.45 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 N-CA-C 108.859 -1.247 . . . . 0.0 108.859 164.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.435 HG21 ' N ' ' A' ' 6' ' ' ASP . 5.3 mp 60.19 159.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -166.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.435 ' N ' HG21 ' A' ' 5' ' ' ILE . 10.7 t70 -79.96 72.76 6.74 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.117 -0.989 . . . . 0.0 110.394 -177.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 10.4 m0 -73.23 155.34 39.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.179 174.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -72.87 102.07 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.067 0.461 . . . . 0.0 110.063 -177.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -87.19 124.91 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.112 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.45 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 66.9 t80 -120.36 110.98 17.18 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.177 174.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 66.88 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.101 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -149.07 17.33 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.926 0.393 . . . . 0.0 110.625 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.466 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 36.8 m-80 -125.92 151.01 47.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.463 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.733 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 80.3 m -106.25 135.03 48.45 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.325 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.45 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 27.7 m-85 -129.24 134.72 48.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.444 ' HD2' HD22 ' A' ' 18' ' ' LEU . 8.4 t80 -123.73 113.23 28.77 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -89.68 118.35 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.533 2.822 . . . . 0.0 111.858 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.484 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -132.24 140.47 48.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.371 0.605 . . . . 0.0 110.389 178.373 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 p -86.99 5.29 38.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.299 -169.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.4 ' OD1' ' HB2' ' A' ' 18' ' ' LEU . 2.8 m-20 -59.56 135.04 57.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.052 0.453 . . . . 0.0 110.174 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.667 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 2.1 p-10 -96.28 102.3 14.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.022 -176.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.667 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 13.4 mmmt -137.07 155.52 49.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 179.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.7 p -70.72 178.98 2.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.834 -176.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.538 ' CZ2' HG22 ' A' ' 76' ' ' VAL . 49.4 t90 -56.54 -52.7 63.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.12 0.486 . . . . 0.0 110.444 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -67.04 -43.72 82.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.293 -177.294 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.28 -31.54 64.13 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -174.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 p -67.26 -35.26 79.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.581 175.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' HB2' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -66.25 -30.98 71.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.739 173.975 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 11.1 mmt-85 -83.24 -25.59 31.55 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.105 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.518 ' O ' ' HE1' ' A' ' 34' ' ' MET . 3.2 t-20 -77.61 -26.39 50.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.7 m -85.87 178.88 7.15 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 166.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.731 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 6.9 p 81.39 -41.23 0.15 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.79 0.836 . . . . 0.0 111.565 172.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.81 -23.09 58.49 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 116.202 -0.454 . . . . 0.0 113.008 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.518 ' HE1' ' O ' ' A' ' 30' ' ' ASN . 1.3 pmm? -100.62 15.73 27.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.658 0.266 . . . . 0.0 110.914 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.18 47.59 7.43 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.2 -175.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.731 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -142.98 -174.37 4.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.835 0.35 . . . . 0.0 110.649 -173.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.651 ' CD2' ' HB2' ' A' ' 77' ' ' ASP . 9.6 t60 -148.48 162.16 40.18 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 171.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 28' ' ' GLU . 21.9 tp -56.95 145.73 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.734 ' HE3' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -60.4 113.67 2.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.542 0.686 . . . . 0.0 112.443 -173.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.754 ' HB ' HG13 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -106.92 109.71 21.67 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.252 170.164 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.734 HG12 ' HE3' ' A' ' 39' ' ' MET . 54.2 mt -64.6 111.68 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.975 -179.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.1 m -97.16 -31.65 12.35 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.787 -174.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.552 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 21.9 p -128.04 153.27 46.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.85 0.833 . . . . 0.0 112.433 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.436 ' CG ' ' HG2' ' A' ' 85' ' ' ARG . 19.3 mt-10 -66.69 -36.12 81.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.965 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.11 79.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.033 0.444 . . . . 0.0 110.425 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.552 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.8 tt0 -55.58 -54.54 42.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.406 ' O ' HG23 ' A' ' 51' ' ' ILE . 21.5 tm0? -57.74 -48.86 78.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.641 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -64.02 -27.73 69.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.277 -176.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -89.23 -41.24 12.32 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.58 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.9 tp -62.51 -35.52 70.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 -176.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.642 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 41.5 pt -68.1 -9.22 10.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.497 -178.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -82.81 -30.0 29.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.24 -28.8 25.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.694 -178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 69.4 mt -62.86 158.02 20.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.504 ' OD2' ' HB3' ' A' ' 57' ' ' ARG . 15.8 t70 -78.88 -2.45 39.92 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.994 -1.003 . . . . 0.0 112.975 -171.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.71 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 10.9 mpt_? 64.94 -57.51 0.27 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -172.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.504 ' HB3' ' OD2' ' A' ' 55' ' ' ASP . 13.5 ttp180 -61.99 -27.73 69.07 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 122.982 0.513 . . . . 0.0 111.864 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.51 147.32 24.04 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.367 0.603 . . . . 0.0 112.243 -175.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.9 m -100.93 130.54 46.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.72 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.454 ' HA ' ' O ' ' A' ' 123' ' ' SER . 86.2 m-85 -112.94 124.34 52.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -174.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -69.99 127.93 34.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.033 174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -169.71 -177.48 2.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.648 179.334 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.405 ' HA2' ' CZ3' ' A' ' 75' ' ' TRP . . . 83.77 -115.03 3.98 Favored Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 115.23 0.852 . . . . 0.0 115.23 163.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 75' ' ' TRP . 3.2 mm? -93.67 154.32 17.88 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.132 -0.534 . . . . 0.0 110.577 -170.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.446 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 14.0 ttm180 -93.6 104.33 16.45 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.727 ' HB2' ' HA ' ' A' ' 101' ' ' CYS . 5.4 m-20 -97.0 75.4 2.64 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.993 0.902 . . . . 0.0 108.778 178.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.623 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 13.8 tt0 -112.39 121.16 44.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 114.574 -1.193 . . . . 0.0 110.624 -171.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.543 ' HB3' ' HZ1' ' A' ' 70' ' ' LYS . 3.0 t-20 67.86 15.87 9.61 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.469 0.48 . . . . 0.0 110.688 172.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.91 35.1 24.85 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.492 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.623 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 23.8 mttm -64.46 137.21 57.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.407 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -68.59 -15.32 68.38 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.064 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -86.95 86.0 7.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.664 ' HZ3' ' HA ' ' A' ' 66' ' ' ASP . 71.9 m95 -75.54 133.7 40.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.09 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.544 HH21 ' HA ' ' A' ' 78' ' ' GLN . 73.2 ttt180 -150.47 149.11 29.56 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.473 ' HA ' HD12 ' A' ' 64' ' ' LEU . 78.0 m95 -69.66 169.92 11.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.34 0.591 . . . . 0.0 111.01 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.754 HG13 ' HB ' ' A' ' 40' ' ' THR . 8.8 p -62.57 -19.31 22.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.714 -178.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.651 ' HB2' ' CD2' ' A' ' 37' ' ' HIS . 20.5 t70 -147.67 103.57 3.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.471 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.544 ' HA ' HH21 ' A' ' 74' ' ' ARG . 45.4 tp60 64.88 -64.68 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.421 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 7.4 m -42.99 127.89 3.25 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 124.206 1.002 . . . . 0.0 112.963 -173.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.7 Cg_exo -74.89 159.68 41.44 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.087 2.525 . . . . 0.0 111.687 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -54.64 133.07 46.57 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.752 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 11.0 t-20 -103.97 128.4 27.29 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.658 -175.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.3 Cg_exo -67.92 -36.25 18.46 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.01 2.474 . . . . 0.0 113.904 -177.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 33.0 ttp180 -96.13 -34.73 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.623 -176.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.436 ' HG2' ' CG ' ' A' ' 44' ' ' GLU . 95.8 mtt180 -93.14 25.4 3.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.301 0.572 . . . . 0.0 110.814 -172.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 86' ' ' VAL . 6.0 p -90.88 95.39 5.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.978 0.894 . . . . 0.0 109.619 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.25 73.36 10.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.291 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 25.5 m95 -66.75 166.64 12.73 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.499 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 1.002 ' HB3' ' HB2' ' A' ' 92' ' ' GLU . 6.2 t-80 -100.84 56.74 0.87 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.537 -172.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt 63.27 -86.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.826 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.454 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 3.8 p-10 -103.82 5.57 36.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.384 -177.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 1.002 ' HB2' ' HB3' ' A' ' 89' ' ' HIS . 33.6 mt-10 -107.67 97.91 22.24 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.464 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 88.2 Cg_endo -98.39 -150.76 0.03 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.58 2.853 . . . . 0.0 111.529 176.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.423 ' H ' ' HB2' ' A' ' 93' ' ' PRO . 6.6 p-10 -82.99 130.71 35.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.043 0.449 . . . . 0.0 110.231 175.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.438 HD22 ' HD2' ' A' ' 93' ' ' PRO . 30.9 m-80 -133.52 -152.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.23 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.457 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 22.9 t 68.29 -163.65 0.2 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.045 175.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.69 6.3 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.486 . . . . 0.0 110.794 -176.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 167.23 -44.51 0.25 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.831 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.762 ' HB3' ' H ' ' A' ' 118' ' ' CYS . 47.4 mt-10 -97.49 95.48 7.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.668 ' HB2' ' OD2' ' A' ' 115' ' ' ASP . 4.6 p-10 -131.29 25.76 4.84 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.111 0.482 . . . . 0.0 110.311 -176.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.727 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 93.2 m -46.86 131.21 11.99 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.077 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.84 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 10.4 m -80.14 144.17 11.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.582 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.685 HG11 ' HE1' ' A' ' 120' ' ' PHE . 28.0 m -130.62 150.01 34.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.787 170.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.547 ' HB2' HD21 ' A' ' 62' ' ' LEU . 14.7 tp -83.88 110.53 18.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.404 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 11.1 p -134.46 152.31 33.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 -176.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.699 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 20.0 t80 -87.61 96.85 10.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.649 177.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.574 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 57.6 t30 -133.65 145.59 50.11 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 63.89 16.06 9.57 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.432 0.457 . . . . 0.0 110.414 -176.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.8 t70 78.0 19.55 1.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.136 0.897 . . . . 0.0 111.624 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.44 ' HB3' ' HE3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -141.74 156.29 45.61 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.391 -0.818 . . . . 0.0 111.599 173.643 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.71 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.7 m95 -85.54 128.54 34.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.716 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.563 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -165.27 174.46 10.16 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.64 175.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.84 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 30.3 m0 -80.17 124.48 28.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.97 0.414 . . . . 0.0 111.165 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 8.0 t-20 -99.55 142.25 31.27 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.372 176.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.668 ' OD2' ' HB2' ' A' ' 100' ' ' ASN . 14.4 t70 -84.84 122.65 29.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.414 HG22 ' CE1' ' A' ' 120' ' ' PHE . 0.6 OUTLIER -151.27 149.04 23.66 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 111.54 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.445 ' O ' ' HB3' ' A' ' 120' ' ' PHE . 8.2 Cg_endo -53.01 144.84 44.06 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.883 2.389 . . . . 0.0 111.52 172.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.762 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 26.4 m -81.97 -14.41 56.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.576 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -80.4 -8.95 59.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.459 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.685 ' HE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -74.07 133.62 42.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 170.854 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -112.73 146.26 39.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.471 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.44 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.45 -168.6 3.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.365 -176.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 8.5 t -69.35 166.66 18.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.67 HH11 ' HB2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -153.35 161.84 41.91 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -168.152 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.1 mt -136.55 133.94 49.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.101 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 75.8 m -102.6 142.25 34.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 173.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -121.81 136.01 54.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.852 0.358 . . . . 0.0 110.807 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.733 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 56.2 mt -125.23 135.28 26.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.754 177.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.19 157.21 29.94 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.065 1.843 . . . . 0.0 111.45 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.24 58.19 1.92 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.464 179.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.0 t -69.26 -20.9 63.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 111.568 0.211 . . . . 0.0 111.568 -176.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.6 m -66.09 -26.54 67.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.142 0.496 . . . . 0.0 110.617 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.471 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.8 mp -90.32 -20.84 22.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.368 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.01 -28.46 22.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.429 0.633 . . . . 0.0 109.35 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.67 39.31 0.95 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.716 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.32 -49.56 71.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.851 -174.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -83.2 -26.8 30.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.011 0.434 . . . . 0.0 110.267 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 58.1 mt -62.54 -52.59 62.85 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.601 178.289 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -75.05 -19.3 60.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.279 0.562 . . . . 0.0 110.057 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.02 -39.71 95.56 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -87.76 -44.53 11.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.271 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.46 -177.764 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.701 ' HG3' HG21 ' A' ' 132' ' ' THR . 63.6 ttp . . . . . 0 N--CA 1.481 1.106 0 CA-C-O 120.759 0.314 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.48 HG22 ' OG1' ' A' ' 132' ' ' THR . 17.0 m -98.48 119.59 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.675 0.75 . . . . 0.0 111.951 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.2 m -147.39 141.15 15.5 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.347 171.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.433 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 41.1 Cg_exo -57.27 149.15 66.28 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.489 2.126 . . . . 0.0 112.155 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.74 -14.84 18.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.403 0.621 . . . . 0.0 111.132 -176.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.7 -30.61 67.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.262 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.536 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 23.0 m95 -90.96 161.47 15.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.015 -173.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 50.3 mmt-85 -115.7 136.19 53.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.931 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -102.91 135.83 43.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.916 0.389 . . . . 0.0 111.579 -176.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.418 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 73.6 t80 -137.97 110.18 7.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.621 175.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 66.0 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.209 -176.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.6 m -151.92 30.19 0.57 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.268 0.556 . . . . 0.0 109.759 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 17.7 m-80 -129.02 149.9 50.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.384 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 85.5 m -124.89 127.14 46.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 109.928 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.418 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 5.6 m-85 -117.0 141.59 48.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.194 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.536 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 26.4 t80 -128.74 114.9 19.25 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-O 120.73 0.3 . . . . 0.0 110.367 175.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -88.79 138.41 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.998 2.465 . . . . 0.0 112.23 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.426 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 5.1 mp -122.48 149.66 43.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.093 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 20' ' ' ASP . 2.6 p -101.16 66.29 1.12 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.886 -167.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.431 ' HA ' ' C ' ' A' ' 122' ' ' ALA . 32.0 t70 81.42 178.39 0.08 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.708 165.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 0.5 OUTLIER 86.57 15.23 0.11 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.569 1.147 . . . . 0.0 112.326 174.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.807 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 70.0 mmtt -139.28 148.23 42.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.95 0.405 . . . . 0.0 111.376 176.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.6 p -85.17 172.2 11.39 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 75.4 t90 -62.16 -39.96 94.37 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.502 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.09 -58.14 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.229 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.807 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 52.2 mm-40 -56.7 -37.75 71.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.538 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.505 ' HB3' HD22 ' A' ' 38' ' ' LEU . 71.7 m -54.59 -50.73 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.538 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HA ' ' HB2' ' A' ' 31' ' ' CYS . 9.0 tp10 -81.11 -21.66 39.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.737 0.303 . . . . 0.0 110.767 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 99.2 mtt180 -65.67 -42.98 90.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.074 0.464 . . . . 0.0 110.066 172.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -74.59 -28.22 60.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.226 178.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.434 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 81.4 m -84.33 178.54 7.73 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.149 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 61.2 m 71.78 -45.66 0.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.67 0.388 . . . . 0.0 111.077 -174.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.96 -18.39 70.66 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.2 -0.524 . . . . 0.0 111.965 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.6 mtm -97.99 3.82 49.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.329 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.9 89.45 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.89 -0.672 . . . . 0.0 111.891 -175.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -100.36 -176.58 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.722 -0.239 . . . . 0.0 110.873 -178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -149.31 165.09 33.02 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.505 HD22 ' HB3' ' A' ' 27' ' ' SER . 33.2 mt -60.32 144.81 49.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.069 0.461 . . . . 0.0 111.442 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.639 ' HE1' HG12 ' A' ' 41' ' ' ILE . 0.5 OUTLIER -57.79 120.02 7.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.982 -175.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.529 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 53.9 p -116.86 101.91 8.94 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.646 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.639 HG12 ' HE1' ' A' ' 39' ' ' MET . 39.2 mt -64.8 109.2 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.212 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 m -95.78 -37.83 10.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.462 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.9 p -125.66 154.09 42.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.545 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -68.39 -30.23 69.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.449 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.38 -47.27 86.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.198 175.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -53.18 -47.35 68.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.277 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -60.82 -53.57 55.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.15 176.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -57.81 -31.02 66.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.433 -174.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.449 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 34.1 m-85 -82.56 -39.24 22.56 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.7 tp -73.28 -32.22 36.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.576 -0.45 . . . . 0.0 111.35 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.412 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 34.6 pt -69.34 -9.07 11.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.478 . . . . 0.0 111.234 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -78.64 -27.42 45.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.161 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -91.51 -27.67 18.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.801 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.0 mt -68.95 134.32 49.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.663 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.419 ' HB3' HD21 ' A' ' 58' ' ' LEU . 12.7 t70 -61.5 128.74 37.78 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 171.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.564 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 64.9 mtt180 -85.48 32.02 0.58 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -168.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.829 ' HG2' HD23 ' A' ' 58' ' ' LEU . 2.0 ptp180 -127.03 -24.45 3.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.507 174.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.829 HD23 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -86.31 162.3 18.3 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.277 0.561 . . . . 0.0 112.074 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.6 p -112.55 112.74 24.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 174.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.552 ' HB3' HG13 ' A' ' 125' ' ' ILE . 62.7 m-85 -99.36 120.74 40.07 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.692 ' HA ' HG11 ' A' ' 103' ' ' VAL . 24.3 m-85 -59.12 128.99 39.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.071 0.462 . . . . 0.0 111.734 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.8 HD13 ' HG ' ' A' ' 104' ' ' LEU . 98.9 mt -103.53 157.43 17.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.194 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.588 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -78.98 39.39 2.03 Favored Glycine 0 C--O 1.223 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 113.333 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.619 ' HB3' HG23 ' A' ' 102' ' ' VAL . 33.2 tp -105.04 116.35 31.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.414 0.607 . . . . 0.0 109.621 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.3 ttt85 -115.03 127.73 55.83 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -172.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -122.91 107.37 11.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.688 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.4 tt0 -99.71 118.73 36.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.679 -172.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.0 m120 69.0 21.5 7.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.431 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.94 70.07 0.68 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.687 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.688 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 61.1 mttp -91.59 -16.77 26.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.949 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.77 12.63 82.8 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -109.43 74.99 0.92 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.058 -0.571 . . . . 0.0 109.656 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.642 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.7 m95 -66.68 104.23 1.26 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 178.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -123.68 144.62 49.53 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 -174.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TRP . . . . . 0.588 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 89.8 m95 -85.99 131.66 34.23 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.1 p -57.82 -27.92 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.989 -175.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.487 ' HB3' HG23 ' A' ' 40' ' ' THR . 2.3 t70 -55.92 -62.43 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.039 173.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 77' ' ' ASP . 21.8 tm0? 163.44 -29.89 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.411 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.6 m -42.08 121.74 2.48 Favored Pre-proline 0 C--O 1.235 0.333 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.09 -178.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -66.96 161.28 43.2 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.647 2.231 . . . . 0.0 111.385 173.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.642 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 56.5 t80 -69.02 142.46 54.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.833 -178.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.465 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 45.0 m-80 -103.1 96.84 8.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.305 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 17.7 Cg_exo -67.33 -29.85 37.75 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.519 2.146 . . . . 0.0 111.539 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -81.04 -11.66 59.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.629 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.465 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 92.2 mtt180 -129.44 55.51 1.76 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.176 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.73 138.06 27.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.924 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -130.77 71.6 1.47 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.298 -177.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -75.84 168.95 19.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.765 ' HB3' ' HB2' ' A' ' 92' ' ' GLU . 3.9 m-70 -95.02 106.59 18.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.024 173.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.46 ' HG2' ' OD1' ' A' ' 91' ' ' ASN . 88.1 tttt -62.87 130.04 43.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.669 -178.274 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.46 ' OD1' ' HG2' ' A' ' 90' ' ' LYS . 23.4 m120 70.09 16.44 7.49 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.275 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.765 ' HB2' ' HB3' ' A' ' 89' ' ' HIS . 35.4 mt-10 -125.44 121.69 24.89 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.193 172.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.03 115.83 3.35 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.498 2.132 . . . . 0.0 111.985 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.552 ' OD1' ' HA ' ' A' ' 114' ' ' ASN . 63.7 m-20 -110.95 81.32 1.41 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.623 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 94' ' ' ASP . 3.7 t-20 176.73 101.78 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.976 177.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.777 ' HB2' ' HB3' ' A' ' 100' ' ' ASN . 15.6 m -86.42 15.08 5.74 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 45.35 25.83 0.24 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.791 1.237 . . . . 0.0 113.825 175.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -137.08 -143.16 4.53 Favored Glycine 0 CA--C 1.505 -0.553 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 177.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.549 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 9.4 pt-20 -88.75 86.17 6.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 118.498 1.149 . . . . 0.0 108.186 168.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.777 ' HB3' ' HB2' ' A' ' 96' ' ' SER . 1.3 p-10 -109.43 163.06 13.76 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.466 -1.243 . . . . 0.0 111.314 -172.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.11 148.24 28.06 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.306 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.619 HG23 ' HB3' ' A' ' 64' ' ' LEU . 20.9 m -88.56 147.21 5.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.209 0.528 . . . . 0.0 111.344 -176.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.692 HG11 ' HA ' ' A' ' 61' ' ' PHE . 34.5 m -118.59 152.76 20.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.411 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.8 ' HG ' HD13 ' A' ' 62' ' ' LEU . 17.4 mt -83.09 103.41 12.5 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.01 138.34 53.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.488 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -87.71 96.52 10.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.478 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASN . . . . . 0.456 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 62.2 t30 -140.88 147.17 38.49 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 64.4 24.25 13.15 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.648 0.593 . . . . 0.0 109.705 -172.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 66.59 22.6 10.5 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.315 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -134.41 151.31 51.11 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.969 -0.457 . . . . 0.0 111.199 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TRP . . . . . 0.564 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 81.9 m95 -88.71 108.6 19.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.509 171.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -143.45 165.76 26.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.93 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.573 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.3 m0 -78.0 125.67 29.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.39 -177.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.552 ' HA ' ' OD1' ' A' ' 94' ' ' ASP . 2.7 t-20 -121.99 125.7 46.9 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 172.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.44 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 20.0 t70 -84.17 128.08 34.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.213 0.53 . . . . 0.0 111.744 -173.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.59 159.03 69.21 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.552 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.546 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.4 Cg_endo -55.85 137.93 80.23 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.384 2.056 . . . . 0.0 111.929 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 90.1 m -69.74 -9.1 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -178.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -98.85 13.24 33.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.627 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.546 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 61.9 t80 -89.08 140.36 29.53 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.611 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -82.57 125.13 30.81 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 177.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.534 ' HB2' ' CE2' ' A' ' 61' ' ' PHE . . . -157.49 -167.25 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.044 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 20' ' ' ASP . 20.0 m -84.46 175.04 9.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . 0.426 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 1.1 ptm180 -154.83 155.43 34.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.761 0.315 . . . . 0.0 111.733 -173.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.552 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.2 mt -127.9 123.82 61.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.9 t -106.53 134.84 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -119.09 125.76 50.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.94 -177.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ILE . . . . . 0.426 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 11.0 tt -112.08 141.39 24.86 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -68.51 146.5 68.18 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 121.886 1.724 . . . . 0.0 111.029 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.415 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -73.54 63.12 1.87 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.712 176.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.0 t -80.92 22.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.813 0.816 . . . . 0.0 110.946 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.701 HG21 ' HG3' ' A' ' 1' ' ' MET . 5.9 t -66.99 -11.25 56.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.385 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.73 HD23 ' H ' ' A' ' 133' ' ' LEU . 1.9 pt? -74.38 -41.35 61.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.333 0.587 . . . . 0.0 109.989 176.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -87.83 -46.77 9.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.869 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.02 21.0 3.89 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.525 ' HB3' ' O ' ' A' ' 132' ' ' THR . 0.0 OUTLIER -58.58 -59.32 5.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.738 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -71.86 -26.69 62.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.122 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.95 -48.32 76.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -70.99 -25.58 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.146 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -70.32 -39.66 74.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.866 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -75.11 -7.37 53.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.366 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.669 177.582 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 78.4 m . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.499 0.19 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.457 ' O ' ' HD1' ' A' ' 7' ' ' TRP . 59.6 Cg_endo -73.23 128.44 12.94 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.696 2.264 . . . . 0.0 114.752 -172.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mt 65.15 -98.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.735 167.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -114.56 9.79 16.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 111.849 -164.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.564 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.5 m95 -68.29 119.7 13.25 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.508 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 52.7 mmt-85 -72.68 112.11 8.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.689 0.281 . . . . 0.0 110.77 -175.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.83 121.64 24.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 77.9 t80 -139.72 121.69 15.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 60.02 -99.57 0.09 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.398 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 -11.92 9.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.93 0.395 . . . . 0.0 110.492 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -97.46 174.14 6.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.911 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.564 ' HB3' ' HB3' ' A' ' 7' ' ' TRP . 79.5 m -137.79 131.34 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.505 175.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.408 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 46.3 m-85 -120.62 123.86 43.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.872 -174.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 75.5 t80 -118.53 116.95 34.76 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.177 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.5 Cg_endo -84.93 135.33 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.156 2.571 . . . . 0.0 112.358 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.7 mp -122.73 139.35 54.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 p -108.03 22.83 15.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.13 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -87.47 170.32 11.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.123 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -96.04 115.92 28.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.398 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.411 ' HA ' ' OE2' ' A' ' 121' ' ' GLU . 3.5 mmpm? -148.31 146.58 28.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.8 p -73.99 167.44 21.51 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.623 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 57.9 t90 -65.96 -35.14 79.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.54 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.97 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 31.8 mt-10 -76.86 -32.03 57.22 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.533 ' HB2' HD21 ' A' ' 38' ' ' LEU . 7.1 p -68.55 -39.6 81.03 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.576 177.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.9 -33.67 76.37 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.926 173.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.46 ' HB3' ' HA ' ' A' ' 26' ' ' GLU . 8.2 ttt180 -73.03 -42.05 63.57 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.099 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.48 -32.0 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.246 0.546 . . . . 0.0 109.999 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.9 m -84.82 178.15 7.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 170.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 40.2 m 75.86 -44.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.729 0.412 . . . . 0.0 111.061 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.96 -23.9 66.27 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.955 173.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -91.05 7.27 41.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.688 0.28 . . . . 0.0 110.608 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.13 90.7 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.44 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.665 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -101.44 -176.39 3.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.344 -0.428 . . . . 0.0 111.026 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.54 ' ND1' ' HA ' ' A' ' 77' ' ' ASP . 34.0 m170 -143.76 170.66 15.45 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 174.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 27' ' ' SER . 61.1 mt -68.15 163.12 23.32 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.264 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.958 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.4 tpt -53.85 102.33 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.27 0.557 . . . . 0.0 111.799 -177.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.585 HG22 ' HB3' ' A' ' 75' ' ' TRP . 18.3 p -105.55 104.95 14.77 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.127 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 55.5 mt -74.8 95.32 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.892 -175.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.98 -41.26 36.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.868 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 44.9 p -123.65 161.18 25.58 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.907 0.861 . . . . 0.0 111.675 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.93 -16.47 64.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.876 175.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.712 ' HA ' ' OD1' ' A' ' 48' ' ' ASN . . . -79.67 -38.23 34.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.215 174.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -48.38 -49.37 34.89 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.45 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -66.56 -56.36 11.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.857 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.712 ' OD1' ' HA ' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -65.97 -25.14 66.97 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -170.202 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -87.26 -35.0 18.74 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.624 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -71.45 -31.72 43.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 120.271 -0.572 . . . . 0.0 111.201 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.4 pt -71.48 -4.67 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.935 0.397 . . . . 0.0 111.111 -179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -86.91 -19.46 28.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.645 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.13 -17.48 17.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.235 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.8 mt -82.83 144.19 30.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.287 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.94 133.34 40.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.982 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -76.43 53.26 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.786 -175.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.625 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -162.47 -31.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.201 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.625 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -87.17 158.97 19.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.22 0.534 . . . . 0.0 111.267 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.8 m -110.51 121.02 44.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.223 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 84.0 m-85 -107.4 123.74 48.81 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.824 ' HA ' HG12 ' A' ' 103' ' ' VAL . 49.2 m-85 -57.89 137.99 56.17 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.753 HD21 ' HG ' ' A' ' 104' ' ' LEU . 85.1 mt -105.14 163.66 12.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.249 173.236 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.62 14.75 34.31 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.623 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.533 ' HG ' ' CE2' ' A' ' 75' ' ' TRP . 1.1 mt -82.66 116.81 22.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.301 0.55 . . . . 0.0 110.195 178.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.623 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 11.1 ttm180 -113.26 126.26 55.21 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.452 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 12.6 t70 -123.89 145.82 48.85 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 156.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.532 ' HG3' ' HD2' ' A' ' 70' ' ' LYS . 4.8 pt-20 -120.63 6.24 10.54 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -162.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.453 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 179.87 29.92 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.917 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 59.7 38.26 21.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.538 0.685 . . . . 0.0 109.456 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.532 ' HD2' ' HG3' ' A' ' 67' ' ' GLU . 96.8 mttt -81.92 -22.85 36.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.074 -173.118 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 19.66 56.69 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -175.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -100.39 63.59 1.12 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.198 -0.501 . . . . 0.0 110.253 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.8 m95 -70.06 104.35 2.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.679 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.8 mtm180 -134.11 141.1 47.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.407 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.585 ' HB3' HG22 ' A' ' 40' ' ' THR . 79.9 m95 -88.55 125.27 34.7 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 76' ' ' VAL . 6.2 p -70.63 82.62 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-O 122.141 0.972 . . . . 0.0 110.326 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.54 ' HA ' ' ND1' ' A' ' 37' ' ' HIS . 2.1 t70 -172.88 -59.54 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.591 -174.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 163.34 -31.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.888 1.368 . . . . 0.0 107.615 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.466 ' O ' ' HB2' ' A' ' 75' ' ' TRP . 26.3 m -59.98 120.18 48.14 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.925 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 9.5 Cg_exo -75.49 169.18 22.92 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 123.023 2.482 . . . . 0.0 111.287 173.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 61.3 t80 -64.84 125.38 24.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.707 0.289 . . . . 0.0 110.444 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 4.3 m-80 -80.06 110.49 16.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.4 -31.33 17.88 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.694 2.263 . . . . 0.0 112.307 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.7 -11.91 40.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.524 -178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 76.3 mtt180 -127.91 80.39 1.96 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.994 0.426 . . . . 0.0 111.283 -175.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -121.64 98.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -98.94 69.0 1.75 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -65.8 150.03 49.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.953 0.406 . . . . 0.0 111.007 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.506 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 8.7 t-80 . . . . . 0 C--N 1.326 -0.448 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.452 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 5.1 p30 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 121.587 0.708 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 73.1 m -130.04 127.26 39.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.465 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.585 ' HA ' ' HA ' ' A' ' 115' ' ' ASP . 30.4 m -81.63 145.67 8.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 0.0 111.59 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.824 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -128.2 155.46 39.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.009 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HG ' HD21 ' A' ' 62' ' ' LEU . 25.9 mt -86.43 105.83 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 171.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.99 141.32 35.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 53.7 t80 -93.09 96.62 10.17 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.021 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.477 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 45.5 t-20 -138.83 140.46 38.51 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 61.38 27.24 16.89 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 5.5 m-20 62.14 17.06 8.84 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.127 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -121.6 133.37 54.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.383 0.611 . . . . 0.0 111.302 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -79.77 124.98 29.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.071 171.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.506 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -163.56 170.12 17.7 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.595 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -73.65 125.81 28.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.242 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -124.59 120.25 31.37 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.585 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 10.5 p-10 -89.79 124.85 35.01 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.465 0.65 . . . . 0.0 110.378 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -129.38 159.4 69.45 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.965 -178.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -49.57 128.55 21.16 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.52 2.147 . . . . 0.0 110.781 172.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.553 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 10.6 m -74.07 -4.09 33.42 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.901 0.382 . . . . 0.0 111.446 -173.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -90.44 0.5 57.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.552 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -82.99 140.97 32.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.87 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.411 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 8.8 mt-10 -93.05 132.2 37.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.105 0.479 . . . . 0.0 111.153 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -152.9 -171.4 3.92 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.343 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 36.2 m -81.2 170.31 16.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 14.2 ptt180 -149.08 159.85 43.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.201 0.524 . . . . 0.0 112.32 -171.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.958 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 39.9 mt -123.55 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.1 t -112.33 130.4 55.96 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -115.63 123.89 49.55 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.655 -176.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.461 HG22 ' HB2' ' A' ' 14' ' ' CYS . 13.8 tt -114.06 135.83 22.14 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 176.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.72 167.02 22.26 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.413 2.075 . . . . 0.0 111.015 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.9 54.1 2.15 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.058 177.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.7 t -88.06 2.22 52.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.055 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.3 m -61.9 -26.86 68.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.034 0.445 . . . . 0.0 110.487 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.92 -30.07 69.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.301 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -87.5 -14.51 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.203 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.586 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -90.76 22.03 3.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.936 -175.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -64.41 -63.65 1.08 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.166 -0.214 . . . . 0.0 111.426 -176.469 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.55 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 37.7 m-80 -85.18 -23.7 28.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.982 0.42 . . . . 0.0 110.138 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.586 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 2.3 tm? -58.96 -54.88 42.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.928 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.681 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 56.5 t80 -75.58 -20.35 58.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.058 0.456 . . . . 0.0 110.343 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -66.32 -28.33 68.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 0.0 109.851 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -86.95 -31.15 20.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.65 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' SER . . . . . 0.681 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 99.0 p . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.462 -171.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.658 ' N ' ' HG1' ' A' ' 132' ' ' THR . 29.6 p . . . . . 0 N--CA 1.451 -0.411 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 12.6 Cg_exo -70.91 170.5 17.81 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.841 2.36 . . . . 0.0 111.401 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.563 ' H ' HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -61.68 -10.34 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.917 0.389 . . . . 0.0 111.193 176.296 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.37 -35.63 81.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.191 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HD2' ' A' ' 4' ' ' PRO . 16.2 m95 -84.85 142.78 29.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.301 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -85.19 107.34 17.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.801 0.334 . . . . 0.0 110.171 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.39 135.48 39.48 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.86 178.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 78.5 t80 -133.8 110.09 9.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.547 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 67.64 -68.42 0.16 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.041 0.838 . . . . 0.0 110.932 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 p -145.88 -28.24 0.43 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.94 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -86.37 170.95 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.912 0.386 . . . . 0.0 111.15 -174.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.543 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 8.3 m -123.23 132.7 54.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.773 -176.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.472 ' CE1' ' HB2' ' A' ' 127' ' ' LYS . 90.2 m-85 -129.03 129.89 45.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.732 0.301 . . . . 0.0 111.519 -174.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 59.6 t80 -129.5 117.79 18.79 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.891 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -88.58 136.33 3.21 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.293 2.662 . . . . 0.0 112.262 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.58 137.81 52.35 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.8 p -91.05 -4.17 56.58 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.104 0.478 . . . . 0.0 111.061 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.51 ' O ' ' HA ' ' A' ' 123' ' ' SER . 16.3 t70 -77.22 154.01 33.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.935 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.46 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 43.3 m-80 -108.5 140.2 42.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.712 0.291 . . . . 0.0 111.566 -170.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.848 ' HB2' ' HD3' ' A' ' 124' ' ' ARG . 48.8 mmtt -168.22 148.48 4.81 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.231 -177.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.532 HG23 ' OE2' ' A' ' 121' ' ' GLU . 73.2 p -64.47 173.34 2.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.481 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.402 ' HH2' ' HA ' ' A' ' 76' ' ' VAL . 13.2 t90 -60.24 -45.9 91.64 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.167 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -61.68 -48.9 78.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.722 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 4.7 mm-40 -60.59 -40.86 93.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.478 179.165 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.621 ' HA ' ' HD2' ' A' ' 124' ' ' ARG . 70.9 m -56.84 -45.58 82.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.307 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -76.91 -21.43 54.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.989 -176.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 34.7 mtm180 -73.08 -43.32 61.98 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.28 0.562 . . . . 0.0 110.149 173.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.49 -35.6 79.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.809 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' SER . 0.1 OUTLIER -85.56 -179.24 6.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.329 174.139 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 57.8 m 75.25 -43.91 0.52 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.784 0.434 . . . . 0.0 112.06 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.95 -21.06 60.79 Favored Glycine 0 C--O 1.227 -0.3 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.032 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.7 ptp -100.16 8.25 43.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.017 0.437 . . . . 0.0 110.636 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.82 29.97 53.32 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.343 -178.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.86 -178.8 4.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.545 0.212 . . . . 0.0 110.918 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.525 ' HB3' HG11 ' A' ' 76' ' ' VAL . 4.7 m-70 -143.12 168.2 20.31 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -57.42 157.45 6.66 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 111.62 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.633 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.6 tpt -52.92 99.4 0.02 OUTLIER 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.505 -176.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.507 ' H ' ' HG2' ' A' ' 127' ' ' LYS . 7.4 p -97.15 90.44 5.14 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.314 170.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.444 HD11 HD11 ' A' ' 104' ' ' LEU . 42.5 mt -55.65 106.08 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.862 -178.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m -70.78 -51.47 26.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.596 -177.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.6 p -130.12 161.38 31.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.38 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.499 ' CD ' HH21 ' A' ' 84' ' ' ARG . 6.1 pt-20 -66.69 -27.94 68.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.986 0.422 . . . . 0.0 110.293 176.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.02 -36.78 84.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.164 174.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.56 -45.71 91.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.168 176.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 51' ' ' ILE . 55.1 tt0 -56.95 -53.88 52.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.05 175.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -58.87 -24.14 61.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.161 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -81.99 -52.08 7.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -66.92 -30.54 49.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.768 0.318 . . . . 0.0 111.619 -172.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.704 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.3 pt -73.16 -1.41 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.996 0.426 . . . . 0.0 111.746 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -83.58 -26.25 30.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.942 175.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -99.13 -23.78 15.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.484 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 83.6 mt -63.95 135.6 56.64 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.504 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -71.47 124.51 24.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.603 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 81.8 mtt180 -79.05 20.21 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -168.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.873 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.7 ptp180 -116.18 -15.71 11.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.721 0.296 . . . . 0.0 110.356 174.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -97.41 172.64 7.63 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.387 0.613 . . . . 0.0 111.439 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -128.28 117.95 22.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.061 176.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.492 ' HB3' HG13 ' A' ' 125' ' ' ILE . 78.2 m-85 -101.59 127.54 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.315 -171.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.662 ' HA ' HG12 ' A' ' 103' ' ' VAL . 1.7 m-85 -62.04 145.01 54.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.154 0.502 . . . . 0.0 112.232 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.667 ' HB2' HG13 ' A' ' 102' ' ' VAL . 95.9 mt -112.61 168.61 9.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.679 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -74.44 3.8 38.56 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 115.18 0.832 . . . . 0.0 115.18 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.913 ' HB2' HG12 ' A' ' 102' ' ' VAL . 4.0 mm? -73.46 117.34 15.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 118.244 1.022 . . . . 0.0 110.903 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -120.23 122.64 41.36 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.331 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 29.9 t70 -141.78 90.69 2.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.852 0.834 . . . . 0.0 109.911 163.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.679 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -74.45 -71.04 0.36 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.621 -177.767 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -84.67 31.61 0.53 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.459 -170.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 49.73 69.93 0.55 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.219 0.533 . . . . 0.0 111.559 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -95.53 -12.79 25.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.12 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.45 -40.35 2.58 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.014 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -81.16 98.04 7.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.073 0.463 . . . . 0.0 110.751 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.596 ' HB3' HD12 ' A' ' 64' ' ' LEU . 58.6 m95 -59.82 128.04 34.93 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.993 175.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -121.09 129.75 53.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.23 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.756 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 55.6 m95 -81.61 108.14 14.94 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.388 178.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 37' ' ' HIS . 48.0 t 45.77 -80.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.706 1.254 . . . . 0.0 114.117 172.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 75' ' ' TRP . 4.3 t70 -96.33 -82.5 0.39 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.919 -168.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -124.44 -19.21 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.756 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 70.1 m -62.69 118.71 44.11 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 120.936 0.398 . . . . 0.0 111.928 -170.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.5 Cg_exo -71.09 169.8 19.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.616 2.877 . . . . 0.0 112.555 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.2 151.24 47.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.345 0.593 . . . . 0.0 110.976 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.644 ' ND2' ' HB2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -119.4 127.08 26.65 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.125 -174.368 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.4 Cg_exo -67.79 -30.3 34.04 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.859 2.373 . . . . 0.0 112.48 175.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.499 HH21 ' CD ' ' A' ' 44' ' ' GLU . 11.2 tpt180 -78.12 -49.81 13.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.564 0.221 . . . . 0.0 111.484 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.644 ' HB2' ' ND2' ' A' ' 82' ' ' ASN . 29.9 mtm180 -80.49 81.25 6.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.069 0.461 . . . . 0.0 110.431 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.501 HG13 ' CD1' ' A' ' 88' ' ' TRP . 95.9 t -138.26 103.75 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.558 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 113' ' ' TRP . 50.7 m-85 -125.93 39.66 3.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.509 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 66.2 m95 -65.77 160.46 22.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.611 0.243 . . . . 0.0 111.461 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 77.3 m-70 . . . . . 0 CA--C 1.517 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.126 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.552 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 6.9 p30 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 121.346 0.593 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 63.9 m -135.93 144.34 45.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.867 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.913 HG12 ' HB2' ' A' ' 64' ' ' LEU . 12.1 p -100.43 146.74 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 120.987 0.422 . . . . 0.0 111.432 -175.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 61' ' ' PHE . 22.6 m -129.85 156.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.763 175.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.8 mt -88.52 113.4 24.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 171.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -125.8 141.33 45.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.397 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 61.3 t80 -79.92 103.84 10.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.151 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 26.1 t-20 -149.19 135.47 19.21 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.451 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 91.4 mt-30 66.38 31.9 7.97 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -172.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.418 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 12.5 m-20 59.53 26.25 15.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.732 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -145.56 153.1 40.72 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.196 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.704 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 88.0 m95 -87.53 107.05 18.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.853 176.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -129.32 167.31 17.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.944 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.531 ' HB3' HG21 ' A' ' 102' ' ' VAL . 25.2 m0 -74.74 129.16 37.21 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.268 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -127.18 139.63 52.81 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.19 125.24 34.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.737 0.303 . . . . 0.0 111.178 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -143.41 158.05 58.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.513 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -58.28 138.11 84.12 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.517 2.145 . . . . 0.0 111.771 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.6 m -70.49 -18.76 62.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.714 0.292 . . . . 0.0 111.029 -178.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -86.1 16.07 4.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.294 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -100.07 126.63 46.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.532 ' OE2' HG23 ' A' ' 23' ' ' THR . 3.2 mm-40 -73.49 124.18 25.33 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.404 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -144.16 176.64 9.17 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.475 177.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 35.0 m -67.55 157.62 33.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.894 0.378 . . . . 0.0 110.7 -177.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.848 ' HD3' ' HB2' ' A' ' 22' ' ' LYS . 80.6 mtm-85 -124.18 153.15 41.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.999 0.428 . . . . 0.0 111.984 -169.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 58.9 mt -134.92 120.72 31.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 171.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 12.5 m -103.49 131.75 50.34 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.507 ' HG2' ' H ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -123.33 135.55 54.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.221 0.534 . . . . 0.0 110.006 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.543 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -128.62 140.17 37.68 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.562 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.77 166.88 3.37 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.617 2.212 . . . . 0.0 111.981 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -71.57 59.19 1.24 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.008 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 77.4 p -71.6 -22.44 61.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.069 0.461 . . . . 0.0 110.349 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.658 ' HG1' ' N ' ' A' ' 3' ' ' CYS . 1.8 m -71.93 -14.57 61.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.061 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 mp -80.06 -32.35 39.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -31.24 20.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.27 41.6 1.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.52 175.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -44.6 79.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.028 -173.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -72.61 -27.21 62.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.316 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.05 -48.3 74.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -71.53 -23.26 61.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.282 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -67.97 -33.09 73.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 0.0 110.243 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -87.93 -6.47 58.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.435 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.103 -175.829 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.0 m . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -52.82 142.07 52.99 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.063 1.842 . . . . 0.0 111.131 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.3 mt -73.79 80.47 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -173.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 176.68 -51.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.214 -1.357 . . . . 0.0 108.206 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 17.9 m95 -42.23 123.74 2.57 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.295 177.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -71.74 107.21 4.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 128.31 33.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.235 -176.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 83.8 t80 -139.25 102.11 4.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.644 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 60.67 -89.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.139 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 m -120.27 7.56 10.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.682 0.277 . . . . 0.0 111.282 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -130.35 158.51 39.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.856 0.36 . . . . 0.0 110.99 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 128' ' ' ILE . 74.9 m -131.97 127.52 36.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 79.2 m-85 -115.41 129.06 56.45 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -170.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 33.1 t80 -121.34 114.87 31.6 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 174.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 6.5 Cg_endo -88.48 123.36 1.54 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.326 2.684 . . . . 0.0 112.288 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.461 HD22 ' CZ ' ' A' ' 124' ' ' ARG . 4.7 mp -109.82 139.39 44.95 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 p -105.31 14.98 28.07 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.373 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -85.83 162.29 18.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.0 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 20.0 m120 -85.12 118.24 24.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 1.025 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -149.03 141.73 24.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.772 178.191 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 62.8 p -72.63 174.55 7.39 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 174.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.446 ' CH2' HG23 ' A' ' 76' ' ' VAL . 31.2 t90 -62.42 -39.75 94.29 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.3 68.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.764 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 1.025 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 15.8 mm-40 -61.14 -37.32 82.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.456 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.431 ' HB2' HD21 ' A' ' 38' ' ' LEU . 68.8 m -60.05 -49.29 78.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.715 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.621 ' HG2' HD13 ' A' ' 38' ' ' LEU . 19.6 mm-40 -69.69 -22.02 63.45 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.407 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -67.93 -39.81 83.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.79 0.329 . . . . 0.0 110.918 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.28 -25.98 36.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.333 0.587 . . . . 0.0 109.567 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 88.4 m -85.65 -180.0 6.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.522 172.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 51.7 m 73.34 -44.92 0.6 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.928 0.491 . . . . 0.0 111.66 -178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.63 -22.99 66.59 Favored Glycine 0 C--O 1.227 -0.336 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.758 174.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.5 mtm -96.93 9.53 41.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.33 . . . . 0.0 110.696 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.64 27.75 68.68 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.998 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.85 173.83 10.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.475 0.178 . . . . 0.0 111.028 -175.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -140.2 168.66 19.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.621 HD13 ' HG2' ' A' ' 28' ' ' GLU . 10.8 mp -61.44 149.42 38.63 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.209 0.318 . . . . 0.0 110.37 173.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.4 tpt -50.71 103.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -175.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.515 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 11.8 p -94.45 94.85 8.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.077 172.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.483 HD11 HD11 ' A' ' 104' ' ' LEU . 55.9 mt -66.99 95.8 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.237 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.9 m -92.75 -27.79 17.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.299 0.571 . . . . 0.0 109.811 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 53.0 p -125.2 147.87 48.87 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 122.238 1.018 . . . . 0.0 112.163 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.43 ' OE2' ' HD3' ' A' ' 85' ' ' ARG . 19.9 mt-10 -59.9 -31.45 69.83 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.629 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.446 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.4 -46.04 88.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.582 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.464 ' HB3' ' CE ' ' A' ' 39' ' ' MET . 24.7 mt-10 -49.23 -55.29 13.05 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.583 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.36 -52.69 62.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.001 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -59.25 -34.77 72.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.446 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 59.9 m-85 -88.31 -37.7 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.6 tp -70.21 -30.75 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.283 -174.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.492 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 37.4 pt -71.29 -6.08 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.309 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -87.44 -21.54 25.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.025 176.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -94.81 -23.91 17.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.636 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.6 mt -74.28 139.84 44.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.543 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.421 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -75.36 133.81 41.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 81.5 mtt180 -80.22 16.71 1.19 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -169.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.939 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.9 ptp180 -119.59 -12.31 9.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.719 176.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.939 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -103.11 148.3 25.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.174 0.511 . . . . 0.0 111.607 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 p -100.5 116.91 33.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.541 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB3' HG13 ' A' ' 125' ' ' ILE . 95.4 m-85 -100.77 121.69 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.48 -174.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.838 ' HA ' HG12 ' A' ' 103' ' ' VAL . 14.1 m-85 -58.41 137.42 57.29 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.765 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' A' ' 104' ' ' LEU . 96.4 mt -105.61 157.11 17.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.942 176.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.463 ' O ' ' HE3' ' A' ' 75' ' ' TRP . . . -79.06 61.83 4.07 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.442 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.606 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 21.3 tp -129.64 134.22 47.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -135.33 134.91 40.33 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -170.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -133.61 88.96 2.53 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 164.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -81.84 134.05 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.89 0.376 . . . . 0.0 111.519 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 70.07 18.41 7.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.47 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.23 87.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.314 0.578 . . . . 0.0 111.662 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.467 ' HE3' ' HB2' ' A' ' 70' ' ' LYS . 21.2 mtmt -112.38 -47.72 3.07 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.414 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.8 -19.3 47.59 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.9 83.85 4.06 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 121.227 0.537 . . . . 0.0 110.033 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.606 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 60.5 m95 -66.23 137.28 56.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.501 -178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.419 ' O ' HD12 ' A' ' 64' ' ' LEU . 63.7 mtt180 -125.65 166.11 17.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.545 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 96.7 m95 -81.56 176.56 9.56 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.719 -0.793 . . . . 0.0 109.307 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.446 HG23 ' CH2' ' A' ' 24' ' ' TRP . 13.7 p -63.07 -34.4 66.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.854 0.359 . . . . 0.0 111.38 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -107.24 -168.78 1.44 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 177.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -77.6 73.72 4.17 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.42 0.629 . . . . 0.0 110.161 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 8.1 m -131.15 129.22 22.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.222 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 19.3 Cg_exo -68.66 144.91 61.83 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.237 2.625 . . . . 0.0 112.271 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 86' ' ' VAL . 68.3 t80 -69.43 143.43 53.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.17 -176.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 25.3 m-80 -77.55 110.39 12.55 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.704 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.94 -50.37 0.84 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.984 2.456 . . . . 0.0 112.776 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -82.71 -0.88 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 111.507 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 29.8 mtm180 -129.55 62.85 1.53 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.408 HG23 ' HZ ' ' A' ' 81' ' ' PHE . 13.0 p -85.31 -32.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.261 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 66.7 -70.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 174.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.419 ' HB3' ' H ' ' A' ' 89' ' ' HIS . 76.8 m95 53.49 -158.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.746 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.521 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 16.8 t60 . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.886 0.374 . . . . 0.0 110.952 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.78 ' N ' HD21 ' A' ' 100' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.475 0 CA-C-O 121.414 0.626 . . . . 0.0 110.29 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 2.2 p -157.66 136.57 11.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.964 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 30.1 m -88.67 147.7 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.408 0.623 . . . . 0.0 112.155 -173.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.838 HG12 ' HA ' ' A' ' 61' ' ' PHE . 25.2 m -124.5 158.62 31.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.14 174.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.7 mt -84.0 115.64 22.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.5 p -125.87 141.49 45.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.688 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 63.4 t80 -91.19 97.5 11.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.4 176.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 47.7 t-20 -141.38 132.93 26.97 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 66.18 31.85 8.42 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 123.838 0.712 . . . . 0.0 109.32 -171.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 15.2 m-20 60.09 25.06 14.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 114.55 -1.205 . . . . 0.0 112.414 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -132.97 141.58 48.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 0.0 111.018 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.492 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 83.2 m95 -88.37 110.77 21.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.762 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.521 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -148.47 170.84 17.14 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.089 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -73.91 134.29 43.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.757 -175.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -134.01 123.93 25.4 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.08 131.68 38.5 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 19.4 m -140.75 158.89 64.46 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.337 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -59.22 128.69 28.45 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.302 2.001 . . . . 0.0 111.138 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.556 ' O ' ' HB ' ' A' ' 23' ' ' THR . 83.6 m -65.84 -17.34 64.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -177.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -82.49 -2.29 52.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.771 0.319 . . . . 0.0 111.263 177.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -83.7 115.45 22.19 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 1.4 mt-10 -72.34 110.64 6.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.452 0.644 . . . . 0.0 110.671 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -130.44 -172.05 2.7 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.511 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 33.1 m -78.25 169.57 18.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.461 ' CZ ' HD22 ' A' ' 18' ' ' LEU . 11.9 ptt180 -151.04 150.24 30.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.098 0.475 . . . . 0.0 111.91 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.642 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.1 mt -115.24 121.37 67.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.94 121.46 44.82 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.515 ' HD3' ' H ' ' A' ' 40' ' ' THR . 22.3 ptmt -115.41 127.36 55.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.985 0.422 . . . . 0.0 111.048 -176.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.549 HG22 ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -103.98 134.18 19.85 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.24 167.47 25.79 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.076 1.85 . . . . 0.0 110.938 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -68.26 60.86 0.41 Allowed Glycine 0 CA--C 1.521 0.442 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.131 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -76.63 10.37 2.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.198 0.523 . . . . 0.0 111.304 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.9 m -67.28 -18.58 65.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.583 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.03 -34.48 66.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.182 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -77.42 -38.3 49.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 0.0 109.337 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -85.46 31.22 0.59 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.981 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 12.3 pt-20 -60.12 -35.21 74.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.715 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.411 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 76.8 m-20 -73.31 -28.64 62.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.548 -177.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -68.17 -20.34 64.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.46 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -71.71 -38.58 70.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -73.91 -40.27 63.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.241 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 44.4 m . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.57 -179.269 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.641 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 71.3 m . . . . . 0 C--O 1.234 0.246 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.641 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 95.1 Cg_exo -46.98 147.68 4.74 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 121.818 1.679 . . . . 0.0 111.851 170.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tp -59.38 146.86 8.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.945 -172.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 77.81 -33.79 0.18 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.51 1.124 . . . . 0.0 112.023 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 24.1 m95 -47.73 118.6 2.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.817 0.341 . . . . 0.0 110.124 175.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.3 mmt-85 -71.47 113.45 8.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.481 -172.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.52 124.13 31.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.774 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.457 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 33.0 t80 -121.44 104.33 9.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 58.89 -101.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.435 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 t -96.91 -36.16 10.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.346 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -80.42 169.12 18.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.562 -173.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.96 136.33 26.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.366 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 24.9 m-85 -121.71 131.86 54.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.251 -169.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -111.67 115.26 51.55 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.198 176.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -89.09 124.85 1.5 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 123.107 2.538 . . . . 0.0 111.574 174.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -138.01 143.9 40.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.402 0.62 . . . . 0.0 111.272 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 73.9 p -110.27 18.77 19.56 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.798 -170.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -78.58 130.51 36.02 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.423 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.621 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 4.8 m-20 -63.48 100.52 0.26 Allowed 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.921 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.621 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 14.8 mmmm -133.63 143.75 48.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.626 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.4 p -65.79 163.85 15.9 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 174.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 60.0 t90 -57.76 -39.35 77.2 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.12 -51.67 68.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.892 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HA ' ' HB2' ' A' ' 29' ' ' ARG . 14.5 mm-40 -70.57 -26.92 63.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.239 -177.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 53.1 m -58.0 -50.39 73.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.763 0.316 . . . . 0.0 110.33 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -70.81 -25.89 63.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.658 178.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -71.1 -51.43 25.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.938 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.431 ' HB3' HH12 ' A' ' 124' ' ' ARG . 3.7 t-20 -74.94 -30.67 61.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.1 0.476 . . . . 0.0 110.579 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.5 m -84.51 179.42 7.41 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.2 m 80.04 -45.11 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.532 0.733 . . . . 0.0 109.966 -174.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.67 -25.7 70.53 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.669 171.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.652 ' HG3' ' H ' ' A' ' 36' ' ' ALA . 21.7 ptp -88.7 1.79 54.49 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 110.573 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.44 -13.11 59.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.217 -176.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.652 ' H ' ' HG3' ' A' ' 34' ' ' MET . . . -95.43 141.13 29.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.89 -0.182 . . . . 0.0 110.512 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.543 ' CD2' HG13 ' A' ' 76' ' ' VAL . 13.5 t60 -118.97 158.14 26.34 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.446 ' HB2' HG21 ' A' ' 76' ' ' VAL . 5.9 mp -51.71 139.03 22.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -174.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.655 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.0 tpt -40.02 98.68 0.01 OUTLIER 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.436 -1.256 . . . . 0.0 113.448 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.56 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 6.4 p -94.79 91.84 6.67 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.453 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 59.9 mt -59.4 100.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.279 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -85.64 -34.4 21.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.032 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 35.1 p -130.23 151.61 50.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.379 0.609 . . . . 0.0 111.374 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -65.86 -35.51 80.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.851 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.3 -41.51 98.57 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 120.914 0.387 . . . . 0.0 110.357 175.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.568 ' HB3' ' O ' ' A' ' 43' ' ' THR . 66.4 tt0 -52.34 -51.76 57.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.611 175.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -46.05 90.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.66 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -62.39 -28.36 69.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.116 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.555 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 15.9 m-85 -85.32 -31.87 22.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.8 tp -78.36 -32.69 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.029 -0.668 . . . . 0.0 111.384 -176.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.2 pt -65.28 -20.47 27.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.5 pt20 -87.79 -11.36 48.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.097 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -92.48 -26.34 18.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.049 0.452 . . . . 0.0 110.03 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 68.0 mt -77.05 159.94 29.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.982 -176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.404 ' OD2' HD13 ' A' ' 58' ' ' LEU . 4.2 t70 -70.61 137.75 50.23 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.826 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -90.23 38.82 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.168 0.509 . . . . 0.0 111.698 -171.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -142.15 -46.83 0.35 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.53 172.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.404 HD13 ' OD2' ' A' ' 55' ' ' ASP . 0.2 OUTLIER -61.67 163.49 7.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.797 0.808 . . . . 0.0 112.737 -171.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.875 ' HB3' HG11 ' A' ' 103' ' ' VAL . 1.4 m -108.17 129.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.94 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.516 ' N ' HG22 ' A' ' 103' ' ' VAL . 97.4 m-85 -117.38 120.15 37.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.517 0.198 . . . . 0.0 111.425 -175.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.94 130.15 42.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.084 0.468 . . . . 0.0 111.175 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 104' ' ' LEU . 80.1 mt -111.63 175.93 5.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.337 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.73 39.44 2.71 Favored Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.69 -175.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.717 ' HB2' HG22 ' A' ' 102' ' ' VAL . 3.5 mm? -100.18 114.32 27.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 65' ' ' ARG . 7.9 ttt85 -120.41 114.8 22.35 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -168.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -127.97 105.68 8.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 166.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -46.81 -78.24 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.902 -1.045 . . . . 0.0 113.265 -175.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -127.8 48.06 2.31 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.269 -170.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.35 70.87 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.595 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -87.57 -15.53 37.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.818 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.83 -45.41 3.47 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -175.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.21 92.13 6.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.692 0.758 . . . . 0.0 110.086 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -69.69 160.83 30.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.375 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 16.5 ptt180 -154.1 171.8 18.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.298 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -84.06 -176.18 6.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.976 0.417 . . . . 0.0 110.197 174.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.543 HG13 ' CD2' ' A' ' 37' ' ' HIS . 13.3 p -82.29 1.29 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.215 0.531 . . . . 0.0 111.486 -171.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.506 ' OD2' HG21 ' A' ' 40' ' ' THR . 1.6 p30 -123.89 -104.74 0.36 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.089 176.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -121.16 -23.59 5.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.466 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.1 m -54.46 123.02 41.6 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.634 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 27.3 Cg_exo -65.18 149.06 89.26 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.135 2.556 . . . . 0.0 111.988 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.82 136.92 57.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.838 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -87.81 112.15 47.01 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.88 7.4 4.63 Favored 'Trans proline' 0 CA--C 1.53 0.296 0 C-N-CA 122.646 2.231 . . . . 0.0 113.705 -174.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -119.27 -27.12 5.71 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.418 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -106.83 34.46 3.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.408 ' O ' HG13 ' A' ' 86' ' ' VAL . 6.2 p -80.42 95.76 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.846 0.832 . . . . 0.0 109.811 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -81.71 72.82 8.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.381 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -69.78 152.39 44.66 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.571 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 11.6 t-80 . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.901 -171.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 121.573 0.701 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 67.5 m -117.66 156.27 28.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.831 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.722 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 23.0 m -103.25 155.79 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.255 0.55 . . . . 0.0 110.819 177.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.875 HG11 ' HB3' ' A' ' 59' ' ' SER . 0.4 OUTLIER -123.03 143.98 34.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.533 176.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 62' ' ' LEU . 17.8 tp -85.49 103.54 14.46 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 171.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.635 HG11 HD21 ' A' ' 114' ' ' ASN . 10.0 p -128.33 139.2 52.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.176 0.512 . . . . 0.0 111.785 -172.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.569 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 11.6 t80 -88.37 104.49 16.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -146.71 142.02 27.39 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 39.6 mt-30 53.46 65.69 1.45 Allowed 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.638 0.586 . . . . 0.0 110.342 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.1 p30 58.76 4.35 0.38 Allowed 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 173.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' A' ' 108' ' ' GLN . 9.4 pttm -155.56 153.56 30.35 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.569 ' NE1' ' HD2' ' A' ' 106' ' ' TYR . 81.0 m95 -84.07 140.54 31.76 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.019 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.571 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -179.27 -179.4 0.55 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.65 0.594 . . . . 0.0 109.907 173.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.722 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 39.4 m0 -88.48 139.33 30.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.728 0.299 . . . . 0.0 111.03 -177.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.635 HD21 HG11 ' A' ' 105' ' ' VAL . 26.0 p30 -123.41 162.19 23.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.04 171.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.35 124.69 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.254 0.346 . . . . 0.0 110.928 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -147.77 141.89 16.1 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.204 175.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.0 Cg_endo -55.86 136.02 72.49 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.476 2.117 . . . . 0.0 111.395 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.0 m -67.15 -17.43 64.85 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.883 0.373 . . . . 0.0 110.665 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.32 7.27 33.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.8 t80 -88.98 143.76 26.63 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.75 135.7 35.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.873 0.368 . . . . 0.0 110.947 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.3 -168.8 1.96 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.543 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.403 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 20.2 m -78.59 169.44 18.24 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.475 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 13.0 ptt180 -147.25 162.91 37.95 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -172.274 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.655 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 8.3 mm -126.19 123.63 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.249 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 93.0 m -123.21 127.65 48.91 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.996 0.427 . . . . 0.0 110.293 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HD3' ' H ' ' A' ' 40' ' ' THR . 21.6 ptmt -116.29 140.14 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.871 -175.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 16.0 tt -125.96 145.29 51.49 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.211 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.06 167.33 14.43 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.514 2.143 . . . . 0.0 111.444 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.32 74.46 0.54 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.757 175.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 25.8 p -83.19 19.51 1.45 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.506 0.323 . . . . 0.0 111.864 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 14.5 t -60.15 -24.94 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.451 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.6 mt -82.1 -23.83 35.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -89.47 -49.51 6.65 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.341 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.52 33.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.67 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.641 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -59.76 -64.21 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -175.706 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.641 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 6.2 p30 -84.3 -20.29 32.36 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.66 -45.52 89.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.566 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -72.69 -21.56 61.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.38 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -73.31 -23.42 60.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.357 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 73.5 mt-30 -86.07 -6.8 58.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 177.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.01 -177.206 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.1 m . . . . . 0 C--O 1.233 0.211 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 66.8 Cg_exo -51.9 154.67 9.56 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.567 2.178 . . . . 0.0 112.489 176.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.8 tp -70.2 -14.88 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.817 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.59 -31.74 68.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.987 176.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 24.1 m95 -86.5 160.67 18.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.704 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 48.3 mmt-85 -111.8 122.89 49.02 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.112 177.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.37 124.29 42.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.121 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.468 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 82.9 t80 -121.8 103.27 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.837 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 65.6 -73.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.1 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 m -139.32 5.38 2.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -175.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -123.95 157.88 33.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.788 0.327 . . . . 0.0 111.003 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.8 m -122.87 128.0 49.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.681 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 3.7 m-85 -119.35 138.15 53.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.18 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.425 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 62.1 t80 -139.23 115.68 8.51 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -88.01 138.11 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.839 2.36 . . . . 0.0 112.293 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.8 mp -124.43 139.6 53.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.974 0.416 . . . . 0.0 110.143 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.5 p -110.31 35.19 3.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.871 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.86 -27.23 40.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.3 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.519 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 46.6 m-80 70.08 116.19 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.62 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 13.3 mmmm -159.37 150.44 19.83 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.672 HG23 ' OE2' ' A' ' 121' ' ' GLU . 16.6 p -60.38 166.8 2.83 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 170.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.463 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 63.3 t90 -59.32 -42.26 90.98 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.511 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.41 -51.34 69.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.74 176.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.636 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 32.4 mm-40 -68.14 -31.22 70.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.467 ' HB3' HD21 ' A' ' 38' ' ' LEU . 54.2 m -65.27 -40.74 94.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.822 0.344 . . . . 0.0 110.236 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -71.31 -34.02 70.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.761 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 98.0 mtt180 -69.68 -40.15 76.54 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.845 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -76.16 -25.82 55.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.39 0.614 . . . . 0.0 109.769 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 32' ' ' SER . 67.0 m -85.68 -179.45 6.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 167.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 29.1 m 79.46 -43.68 0.3 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.064 0.546 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.88 -25.18 67.48 Favored Glycine 0 C--O 1.227 -0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.807 173.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 71.5 mtm -94.61 7.1 46.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.871 0.367 . . . . 0.0 110.392 177.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.6 -6.68 64.26 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.152 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.56 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.39 162.83 13.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.522 0.201 . . . . 0.0 110.69 -177.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -133.4 168.57 18.37 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 27' ' ' SER . 76.1 mt -61.39 146.28 48.8 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.931 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.6 tpt -44.88 110.79 0.25 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.161 0.913 . . . . 0.0 113.178 -172.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB3' ' A' ' 75' ' ' TRP . 23.7 p -101.8 105.76 16.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.892 173.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.545 HD11 HD11 ' A' ' 104' ' ' LEU . 45.4 mt -79.2 119.42 28.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.091 0.472 . . . . 0.0 110.538 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.5 p -106.58 -36.62 6.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.261 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 70.5 p -127.71 152.97 47.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 112.032 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.93 -33.05 74.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.53 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -68.29 -44.45 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.622 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -52.54 -48.71 65.94 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.885 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -59.96 -48.94 79.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.978 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -62.19 -23.09 66.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.238 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.429 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 30.5 m-85 -88.33 -39.07 14.64 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 177.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.552 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -71.4 -30.49 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.305 -176.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.1 pt -71.62 -3.96 4.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.85 0.357 . . . . 0.0 111.312 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -87.25 -21.74 25.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.852 175.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 -19.77 18.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.151 178.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 79.1 mt -79.06 134.05 36.77 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.966 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.25 128.29 35.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.964 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.1 mtt180 -72.39 53.78 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -160.33 -29.95 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.317 177.592 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.702 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -86.9 158.39 19.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.29 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.7 m -109.47 118.89 37.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.527 176.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.754 ' HB3' HG13 ' A' ' 125' ' ' ILE . 91.4 m-85 -105.23 120.91 42.71 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.757 0.281 . . . . 0.0 111.757 -173.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.748 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.8 m-85 -58.6 137.87 57.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.104 0.478 . . . . 0.0 112.048 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.668 HD21 ' HG ' ' A' ' 104' ' ' LEU . 91.1 mt -103.8 166.02 10.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.707 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -87.07 34.74 3.53 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.898 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.6 tp -92.11 114.74 27.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 21.7 ttm-85 -104.19 126.99 51.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -168.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 16.2 t70 -142.24 101.05 3.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.896 168.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.514 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 0.4 OUTLIER -102.18 137.08 40.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.68 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.67 7.17 6.12 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.011 177.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.463 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 69.07 95.94 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.297 0.57 . . . . 0.0 111.448 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.41 ' CB ' ' HG2' ' A' ' 72' ' ' GLN . 92.5 mttt -118.68 -35.73 3.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.78 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.62 -4.28 79.27 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.757 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.41 ' HG2' ' CB ' ' A' ' 70' ' ' LYS . 8.2 pt20 -93.11 100.91 13.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.391 0.615 . . . . 0.0 110.363 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -71.73 112.09 7.54 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.151 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -135.71 141.77 44.95 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 93.9 m95 -78.86 156.92 28.46 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.891 176.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 p -56.9 -45.18 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.36 -174.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -94.03 -158.06 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -81.83 67.8 7.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.187 0.517 . . . . 0.0 110.118 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 13.1 m -130.29 113.05 16.96 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-O 121.305 0.574 . . . . 0.0 110.099 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -69.04 154.43 70.59 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.443 2.762 . . . . 0.0 112.025 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.496 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 85.0 t80 -78.16 133.06 37.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 27.9 m-80 -102.33 104.22 35.94 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.766 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -64.79 -33.62 52.93 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.838 2.359 . . . . 0.0 112.289 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -80.07 -18.31 50.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.057 0.456 . . . . 0.0 110.738 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 82.8 mtt180 -119.28 37.66 4.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.092 0.472 . . . . 0.0 110.995 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.525 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.8 p -93.56 127.93 45.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.432 174.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -110.37 72.14 0.78 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.929 0.395 . . . . 0.0 111.117 -173.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -71.4 174.8 6.07 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.428 0.632 . . . . 0.0 111.423 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.533 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 24.9 m-70 . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 171.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.0 t30 . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.131 0.491 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.2 p -123.24 137.53 54.85 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.968 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.63 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 32.0 m -86.55 148.59 4.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.345 0.593 . . . . 0.0 111.71 -175.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.748 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.4 m -122.06 153.66 26.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.401 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD21 ' A' ' 62' ' ' LEU . 19.1 mt -83.52 106.45 15.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.488 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 7.3 p -125.79 146.2 31.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.442 -177.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.605 ' CE1' ' HA ' ' A' ' 109' ' ' ASP . 86.2 t80 -87.93 109.08 19.53 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.79 -177.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.53 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 19.0 m120 -140.77 127.01 19.71 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 63.21 37.85 10.93 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.42 0.629 . . . . 0.0 109.896 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.605 ' HA ' ' CE1' ' A' ' 106' ' ' TYR . 9.3 t70 73.68 -17.47 0.44 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.117 -1.402 . . . . 0.0 111.959 178.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 112' ' ' ALA . 6.2 pttp -102.22 142.09 34.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.494 0.664 . . . . 0.0 111.029 -175.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -84.35 135.6 34.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.421 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -157.12 165.93 34.65 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.228 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.63 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 20.3 m0 -76.52 123.77 26.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.446 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.488 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 4.6 t30 -111.74 123.62 50.63 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -67.71 123.29 20.09 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.515 0.509 . . . . 0.0 109.871 177.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.474 ' CG2' ' HD2' ' A' ' 117' ' ' PRO . 4.1 p -144.47 146.56 33.13 Favored Pre-proline 0 C--N 1.32 -0.709 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.474 ' HD2' ' CG2' ' A' ' 116' ' ' VAL . 11.6 Cg_endo -57.12 133.29 56.73 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.932 1.754 . . . . 0.0 111.324 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 85.0 m -64.39 -9.36 17.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -96.68 22.64 7.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.03 0.443 . . . . 0.0 110.719 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' THR . 74.1 t80 -99.76 128.04 45.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.698 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.672 ' OE2' HG23 ' A' ' 23' ' ' THR . 45.1 mm-40 -73.67 123.22 23.65 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.519 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -152.05 178.99 8.87 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.1 m -72.96 168.77 18.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -148.19 150.27 33.45 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.998 0.428 . . . . 0.0 112.003 -170.71 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.754 HG13 ' HB3' ' A' ' 60' ' ' TYR . 54.6 mt -116.91 125.15 73.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.271 173.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.7 t -103.25 126.61 50.5 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -128.9 127.23 41.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.768 -171.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.56 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.8 tt -132.15 141.97 43.34 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.58 157.26 62.6 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 121.942 1.761 . . . . 0.0 110.864 171.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.36 58.03 2.85 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.215 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.3 t -87.03 19.31 3.12 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.125 0.57 . . . . 0.0 110.914 -174.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -28.79 58.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.266 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.5 mt -70.18 -31.7 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.491 . . . . 0.0 110.619 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.01 -39.74 14.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.307 0.575 . . . . 0.0 110.121 177.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.83 38.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.728 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.2 -46.86 79.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.729 0.3 . . . . 0.0 111.576 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.574 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 57.1 t30 -75.22 -30.01 60.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.454 -177.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.546 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 6.9 tt -64.64 -48.19 75.74 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -70.26 -20.66 63.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.274 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -75.2 -32.25 61.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.508 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 78.3 mm-40 -87.39 -6.4 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.93 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.998 -176.434 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' A' ' 7' ' ' TRP . 6.0 p . . . . . 0 N--CA 1.449 -0.482 0 CA-C-O 121.099 0.476 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 3' ' ' CYS . 44.3 Cg_endo -68.4 171.13 13.43 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.135 2.557 . . . . 0.0 111.292 174.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 35.7 mt -70.44 70.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.539 0.685 . . . . 0.0 111.184 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -166.96 -42.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.629 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 37.3 m95 -62.41 119.31 8.86 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 164.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -72.43 109.22 5.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.915 0.388 . . . . 0.0 110.783 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.99 121.48 25.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.251 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.612 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 85.5 t80 -139.15 129.87 26.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.447 ' HG3' ' CD2' ' A' ' 10' ' ' PHE . 52.0 mt-30 66.03 -82.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.697 0.623 . . . . 0.0 110.345 -175.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -152.19 8.64 0.48 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.742 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.439 ' OD1' ' HA ' ' A' ' 129' ' ' PRO . 60.5 m-80 -116.98 166.64 11.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.405 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.745 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 4.1 m -118.03 127.49 53.86 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.612 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 35.7 m-85 -122.52 133.13 54.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.497 0.189 . . . . 0.0 111.034 -174.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 52.5 t80 -140.34 117.35 8.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.857 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.1 Cg_endo -84.22 137.43 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.376 2.717 . . . . 0.0 112.105 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.472 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mp -129.44 140.01 51.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.1 p -101.65 21.94 13.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.947 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.52 149.18 50.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.498 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -83.27 97.67 9.0 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 170.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -143.79 145.91 32.71 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.068 0.461 . . . . 0.0 111.065 -172.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.0 p -80.78 173.78 12.27 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.708 173.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 9.6 t90 -65.25 -35.91 82.48 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -64.0 -48.9 74.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.832 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -62.93 -44.11 96.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.246 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.408 ' HB2' HD11 ' A' ' 38' ' ' LEU . 10.9 p -65.13 -33.1 75.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.647 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' HD21 ' A' ' 38' ' ' LEU . 27.2 tt0 -61.57 -37.82 85.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 174.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 15.6 mmm180 -84.49 -36.81 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.403 -176.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -74.0 -37.92 64.26 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.122 0.487 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.5 m -84.81 177.23 8.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 169.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.744 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 18.8 m 75.77 -48.48 0.6 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.497 0.319 . . . . 0.0 110.594 -175.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.88 -30.68 73.65 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 121.288 -0.482 . . . . 0.0 112.229 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 77.7 mtm -80.32 4.16 18.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.984 0.421 . . . . 0.0 110.788 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.72 51.76 7.76 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.744 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -147.02 -175.49 4.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.086 -0.557 . . . . 0.0 109.91 -173.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -149.29 170.43 18.53 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 175.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 28' ' ' GLU . 4.2 mm? -63.59 157.6 23.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.842 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -61.55 96.41 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.394 0.616 . . . . 0.0 111.586 -177.478 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.35 98.34 8.72 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.466 176.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.408 HD11 HD11 ' A' ' 104' ' ' LEU . 52.8 mt -64.6 115.51 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.669 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 -28.13 16.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.103 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 25.5 p -141.38 154.91 45.91 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.532 0.682 . . . . 0.0 111.652 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.41 -37.49 83.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.204 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.401 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -59.82 -41.44 91.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.115 0.484 . . . . 0.0 109.999 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' O ' ' A' ' 43' ' ' THR . 70.3 tt0 -51.5 -51.99 50.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.593 174.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HA ' HG22 ' A' ' 50' ' ' ILE . 53.0 tt0 -58.08 -50.4 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.068 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -56.8 -30.85 64.1 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.234 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.401 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 36.6 m-85 -88.53 -39.31 14.25 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.07 -28.56 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.377 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.49 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.9 pt -70.3 -8.8 11.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.963 0.411 . . . . 0.0 111.403 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -87.68 -18.21 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.308 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -93.03 -20.25 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.068 176.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 82.3 mt -81.84 130.27 35.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.994 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.3 t70 -64.5 136.61 57.23 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 172.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.471 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 84.9 mtt180 -86.99 15.97 5.44 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -169.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.637 ' HG2' HD22 ' A' ' 58' ' ' LEU . 9.8 ptp85 -113.62 -11.99 12.92 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.304 -0.559 . . . . 0.0 111.083 174.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.637 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.3 mm? -99.24 164.56 12.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.284 0.564 . . . . 0.0 111.717 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -120.63 114.4 21.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.254 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 125' ' ' ILE . 47.7 m-85 -102.51 126.62 49.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.587 0.218 . . . . 0.0 111.587 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.785 ' HA ' HG12 ' A' ' 103' ' ' VAL . 33.2 m-85 -62.14 139.87 58.45 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.962 0.41 . . . . 0.0 111.707 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.475 HD21 ' HG ' ' A' ' 104' ' ' LEU . 73.5 mt -105.02 158.56 16.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.145 175.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.4 ' CA ' ' HB3' ' A' ' 38' ' ' LEU . . . -83.2 53.89 4.91 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 114.461 0.544 . . . . 0.0 114.461 -170.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.664 HD21 HG22 ' A' ' 102' ' ' VAL . 2.3 pt? -135.36 150.24 49.89 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -153.35 144.32 22.87 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.433 0.635 . . . . 0.0 111.401 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.825 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 30.7 t70 -107.98 93.57 4.61 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 162.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 3.4 tm-20 -64.97 112.74 3.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.87 -167.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 52.99 34.8 17.77 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.642 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.41 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 66.79 92.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.617 0.723 . . . . 0.0 112.046 175.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 41.3 mttp -126.13 -13.52 6.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 177.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.01 19.73 79.78 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.099 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.79 93.74 4.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.477 0.656 . . . . 0.0 110.706 -178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -71.8 103.24 3.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.541 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -147.92 155.62 41.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.821 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.618 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 80.0 m95 -81.93 168.6 17.73 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 176.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.09 -34.22 67.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -116.09 79.23 1.28 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 70.79 -50.0 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.066 173.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 18.7 m -47.41 124.1 9.07 Favored Pre-proline 0 C--N 1.329 -0.322 0 C-N-CA 123.361 0.665 . . . . 0.0 112.548 -170.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.4 Cg_exo -71.63 153.55 59.8 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 123.168 2.579 . . . . 0.0 111.625 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.51 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 87.4 t80 -61.52 147.06 46.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.366 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.496 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 50.6 m-80 -98.8 100.04 8.9 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.844 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 74.0 Cg_endo -79.65 -24.95 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.355 2.037 . . . . 0.0 112.011 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -91.16 -7.79 50.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.134 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 78.4 mtm180 -134.59 44.97 2.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.12 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 p -95.28 131.55 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.143 0.497 . . . . 0.0 109.839 177.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -115.65 74.5 0.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -175.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -75.12 -179.52 4.42 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 90.9 m-70 . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.405 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.825 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 61.4 t30 . . . . . 0 N--CA 1.453 -0.291 0 CA-C-O 120.726 0.298 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.7 p -157.0 166.1 34.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.273 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.664 HG22 HD21 ' A' ' 64' ' ' LEU . 1.3 m -115.96 153.86 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.888 -176.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 ' HA ' ' A' ' 61' ' ' PHE . 23.1 m -124.88 153.47 31.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.132 177.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.475 ' HG ' HD21 ' A' ' 62' ' ' LEU . 23.4 mt -84.55 109.67 18.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 171.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.0 143.24 41.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.562 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -84.25 102.42 12.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.446 177.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 19.3 t-20 -147.47 136.73 22.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.668 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.477 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 93.1 mt-30 69.94 31.81 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.994 0.808 . . . . 0.0 109.092 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 t0 63.52 22.11 13.05 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.362 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.61 152.76 40.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.66 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.49 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -77.54 138.4 39.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.547 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -166.99 165.62 15.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.621 0.248 . . . . 0.0 110.95 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -77.74 135.31 38.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.55 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -125.36 135.85 52.85 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -73.31 124.7 26.22 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 123.388 0.43 . . . . 0.0 110.393 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.1 m -143.52 156.42 60.17 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.893 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -67.5 132.18 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.237 1.958 . . . . 0.0 110.907 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 81.9 m -62.37 -21.56 65.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.932 0.396 . . . . 0.0 111.309 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -94.93 64.37 2.83 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.496 0.665 . . . . 0.0 110.099 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -140.65 139.91 34.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.21 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -78.3 110.83 13.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.143 0.497 . . . . 0.0 111.22 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.487 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -147.76 179.09 7.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.457 175.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 p -80.54 174.59 11.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.784 0.326 . . . . 0.0 110.402 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.472 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 19.1 ptt180 -144.96 156.35 43.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.039 0.447 . . . . 0.0 111.564 -171.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.842 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 30.6 mt -122.41 131.62 72.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.04 124.22 48.1 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 19.7 tptm -112.28 111.75 22.85 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.504 -172.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.745 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 38.1 mt -96.85 124.35 50.41 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.553 174.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.439 ' HA ' ' OD1' ' A' ' 13' ' ' ASN . 40.3 Cg_endo -69.07 168.74 19.78 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.673 2.249 . . . . 0.0 111.279 177.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.59 37.69 0.1 OUTLIER Glycine 0 CA--C 1.526 0.754 0 N-CA-C 114.497 0.559 . . . . 0.0 114.497 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 129' ' ' PRO . 7.2 t -77.54 -17.53 57.84 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.0 m -62.93 -30.45 71.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.941 173.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.45 -29.17 61.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.479 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -79.68 -29.2 40.74 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.569 0.699 . . . . 0.0 109.631 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.628 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.96 44.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.338 176.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.67 -55.02 34.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.898 -175.463 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 7.5 m-80 -71.84 -27.16 62.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.049 0.452 . . . . 0.0 110.221 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.628 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tm? -60.35 -47.52 85.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.535 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -75.39 -28.12 59.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.571 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.471 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 85.2 t80 -63.36 -25.76 68.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 95.2 mt-30 -79.24 -8.6 59.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.592 178.215 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.867 -177.567 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 73.6 m . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.569 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 51.4 Cg_exo -53.71 160.88 4.98 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.473 2.115 . . . . 0.0 112.439 176.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.567 ' H ' HD12 ' A' ' 5' ' ' ILE . 3.5 mp -58.92 135.11 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.814 -174.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 81.4 -18.51 0.48 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.375 1.07 . . . . 0.0 112.383 173.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.569 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 28.4 m95 -58.97 121.11 10.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 5.2 mpt_? -72.96 103.28 3.71 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.371 -175.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.14 120.85 21.21 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.443 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -128.24 104.77 7.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 61.44 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.612 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -110.63 -37.27 5.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.562 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -101.89 173.25 6.49 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.745 -170.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.562 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 58.0 m -135.57 131.28 35.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 127' ' ' LYS . 69.6 m-85 -118.25 126.14 51.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.815 0.341 . . . . 0.0 111.809 -172.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.49 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 67.0 t80 -111.99 119.61 43.9 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.946 177.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.3 Cg_endo -85.65 134.23 4.64 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.2 2.6 . . . . 0.0 112.184 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 138.66 54.6 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.85 0.357 . . . . 0.0 110.179 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 p -88.68 -4.76 58.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.261 0.553 . . . . 0.0 109.916 174.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 t70 -56.0 139.06 47.81 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.356 178.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 93.7 m-20 -92.82 105.35 17.5 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.609 ' HG3' ' HB2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -139.19 154.08 48.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.775 -178.443 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.5 ' OG1' ' HG2' ' A' ' 26' ' ' GLU . 57.4 p -80.11 168.59 18.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.403 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 23.4 t90 -59.92 -39.83 86.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.041 0.448 . . . . 0.0 110.41 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.12 -48.7 50.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.354 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.609 ' HB2' ' HG3' ' A' ' 22' ' ' LYS . 12.0 mm-40 -69.38 -28.81 66.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.673 0.273 . . . . 0.0 110.821 -177.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.569 ' HB3' HD21 ' A' ' 38' ' ' LEU . 73.2 m -57.94 -45.68 86.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.985 173.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.493 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 6.6 mm-40 -74.78 -18.77 60.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 177.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -73.84 -35.31 64.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.802 0.334 . . . . 0.0 110.923 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.15 -38.91 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.525 0.679 . . . . 0.0 110.022 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.3 m -87.49 179.15 6.61 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.97 174.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.799 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 62.0 m 73.59 -43.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.482 0.313 . . . . 0.0 111.496 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.12 -22.94 65.57 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.907 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mtm -87.51 12.47 12.26 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.162 0.185 . . . . 0.0 110.768 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.457 ' O ' HG13 ' A' ' 128' ' ' ILE . . . 72.61 38.93 57.07 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -172.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.799 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -134.02 -174.27 3.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.949 -0.626 . . . . 0.0 110.512 -171.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.31 168.08 27.29 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 176.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 27' ' ' SER . 41.2 mt -64.79 146.79 54.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.378 0.535 . . . . 0.0 110.799 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.434 ' HG3' ' CE2' ' A' ' 15' ' ' TYR . 23.5 ttt -59.05 126.13 26.43 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 121.451 0.643 . . . . 0.0 111.972 -176.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 33.4 p -118.72 106.96 13.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.717 173.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.6 mt -58.5 104.23 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.733 -176.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.8 m -89.7 -31.36 17.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.789 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 27.3 p -137.42 152.35 49.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.531 0.682 . . . . 0.0 111.604 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.17 -43.41 98.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.688 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.438 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -60.59 -37.15 80.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.497 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' THR . 40.1 tt0 -55.05 -51.39 66.48 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.386 177.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' ILE . 48.1 tt0 -60.03 -47.34 86.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.695 176.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -57.34 -35.26 69.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.889 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.655 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 35.8 m-85 -84.4 -29.2 26.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.4 tp -78.62 -31.1 15.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.047 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.42 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 32.5 pt -72.48 -4.38 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -176.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 11.0 pt20 -87.88 -20.42 26.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 175.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -94.38 -30.14 14.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 81.9 mt -71.09 144.19 50.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.559 -176.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.519 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -76.06 131.85 39.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.381 176.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.562 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 76.7 mtt180 -84.43 27.47 0.7 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -170.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.817 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.0 ptp180 -126.95 -13.78 5.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.699 0.285 . . . . 0.0 110.848 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.817 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -97.66 157.57 15.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.039 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 p -108.96 115.55 30.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.682 174.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB3' HG13 ' A' ' 125' ' ' ILE . 96.2 m-85 -99.55 123.86 44.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -61.39 139.06 58.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.997 0.427 . . . . 0.0 111.824 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.5 mt -114.42 175.49 5.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.145 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.08 -2.37 90.43 Favored Glycine 0 CA--C 1.521 0.468 0 C-N-CA 120.903 -0.665 . . . . 0.0 114.407 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.492 ' HB2' HG22 ' A' ' 102' ' ' VAL . 15.0 mt -79.68 127.48 32.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.809 0.804 . . . . 0.0 110.742 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HG3' ' SG ' ' A' ' 101' ' ' CYS . 35.0 ttt180 -137.63 129.02 28.03 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 19.0 t70 -94.5 147.27 23.43 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 161.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.03 26.77 1.33 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -179.54 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.249 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.59 32.33 21.68 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -167.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 ptpp? -85.26 -19.42 31.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.741 -173.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.32 5.71 59.96 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.397 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -86.58 82.93 7.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 98.7 m95 -69.34 105.88 2.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.362 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -126.43 146.0 50.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.729 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.54 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 76.5 m95 -84.91 139.56 31.76 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.47 -11.8 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.142 0.496 . . . . 0.0 111.689 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.508 ' HB3' HG21 ' A' ' 40' ' ' THR . 32.6 t70 -99.41 29.24 4.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.306 0.574 . . . . 0.0 109.989 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.36 -12.31 0.73 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.33 177.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.3 m -59.38 131.33 87.83 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.113 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.1 Cg_exo -73.97 159.51 44.61 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.889 2.393 . . . . 0.0 112.044 177.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 52.6 t80 -71.29 139.0 49.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.559 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -90.46 114.76 62.27 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.109 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.526 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.8 Cg_exo -74.7 -12.32 22.17 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.115 2.543 . . . . 0.0 112.899 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.526 ' HD2' ' O ' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -123.89 -43.99 2.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.881 0.372 . . . . 0.0 110.764 178.804 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -84.05 52.22 2.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 109.842 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.5 p -98.21 -33.56 4.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.567 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 68.44 -65.19 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.424 0.689 . . . . 0.0 112.67 172.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 39.7 m95 53.89 -169.06 0.06 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.586 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 1.5 t-80 . . . . . 0 N--CA 1.449 -0.51 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.896 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 47.3 t-20 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.255 0.55 . . . . 0.0 109.917 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' ' HG3' ' A' ' 65' ' ' ARG . 29.8 m -103.5 136.47 43.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.634 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 26.8 m -93.25 138.78 19.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.152 0.501 . . . . 0.0 110.961 -179.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.61 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.5 m -116.26 147.5 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.712 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HG ' ' CE3' ' A' ' 111' ' ' TRP . 22.6 tp -83.18 101.88 11.5 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -124.76 141.23 45.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.063 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.562 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 38.0 t80 -86.34 99.32 11.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.505 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -142.32 136.74 29.99 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 66.22 28.14 10.11 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -171.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.2 t70 72.0 -3.04 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.694 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -113.45 143.31 44.72 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.787 -0.57 . . . . 0.0 110.964 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.43 ' CE3' ' HG ' ' A' ' 104' ' ' LEU . 93.4 m95 -69.28 130.19 41.91 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 169.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.586 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -149.58 166.54 28.95 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.029 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.634 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 42.9 m0 -96.37 119.36 34.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.264 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 1.8 t30 -104.45 146.16 29.25 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.86 136.38 40.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 101' ' ' CYS . 4.5 p -158.67 143.84 11.91 Favored Pre-proline 0 C--N 1.317 -0.806 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.2 129.09 29.74 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.058 1.839 . . . . 0.0 110.609 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.1 m -57.44 -28.21 63.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.219 0.533 . . . . 0.0 110.261 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -90.85 70.66 6.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 170.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.46 ' O ' ' HA ' ' A' ' 23' ' ' THR . 83.9 t80 -138.14 133.69 33.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.528 175.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 28.2 mp0 -74.62 109.72 8.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.052 0.453 . . . . 0.0 110.629 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -142.84 179.62 6.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.027 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 48.9 m -74.35 168.47 19.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -137.06 147.82 46.39 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.695 -167.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.591 HG13 ' HB3' ' A' ' 60' ' ' TYR . 50.3 mt -132.23 122.23 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 168.119 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' CYS . . . . . 0.407 ' SG ' HD23 ' A' ' 38' ' ' LEU . 82.4 m -118.09 143.54 46.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.221 0.534 . . . . 0.0 111.279 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.496 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 22.2 ptmt -112.97 143.02 44.98 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.5 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.562 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 10.0 tt -118.57 136.26 24.03 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.41 ' HG2' HG23 ' A' ' 131' ' ' THR . 19.3 Cg_endo -59.91 166.95 7.77 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.472 2.115 . . . . 0.0 111.96 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -44.14 -39.76 5.45 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.552 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.41 HG23 ' HG2' ' A' ' 129' ' ' PRO . 7.7 p 58.98 -12.07 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 173.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 24.2 p -58.91 -51.77 68.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.601 0.239 . . . . 0.0 110.648 177.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.6 mt -54.26 -24.33 18.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.739 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -87.1 -52.17 5.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.231 0.539 . . . . 0.0 110.229 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.01 22.48 3.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.49 -175.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 132' ' ' THR . 60.2 mm-40 -48.83 -66.14 0.45 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.067 0.46 . . . . 0.0 111.685 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.438 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 92.4 m-20 -74.72 -27.51 60.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.0 -46.22 90.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.76 -24.43 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.432 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 86.5 t80 -67.15 -24.91 65.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 97.6 mt-30 -85.24 -5.19 59.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.439 178.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.831 -177.721 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 m . . . . . 0 C--O 1.234 0.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.704 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 44.4 Cg_exo -56.66 163.32 7.21 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.221 1.947 . . . . 0.0 112.007 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.4 tp -56.87 122.15 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.3 t70 66.37 6.18 4.16 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.83 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.704 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 14.5 m95 -63.27 122.95 17.43 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 170.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.594 ' HB3' ' HB2' ' A' ' 15' ' ' TYR . 4.8 tpp180 -72.24 97.59 2.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.015 -165.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -76.42 121.78 23.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.051 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.412 ' HB3' ' OD1' ' A' ' 13' ' ' ASN . 85.1 t80 -132.2 102.21 5.69 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.864 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 67.68 -71.59 0.1 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.196 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -145.88 13.53 1.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.754 0.311 . . . . 0.0 111.47 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 26.0 p30 -132.29 169.26 16.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.437 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 92.6 m -139.77 133.87 31.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.965 0.412 . . . . 0.0 110.012 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.815 ' HE2' ' HG2' ' A' ' 39' ' ' MET . 45.4 m-85 -115.03 142.52 46.52 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -170.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -127.72 113.23 20.72 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.003 169.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -89.92 122.95 1.1 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.095 2.53 . . . . 0.0 112.148 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.506 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.6 mp -112.94 138.8 49.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.903 0.382 . . . . 0.0 110.099 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.8 p -105.65 9.5 33.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.497 -176.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -82.38 136.29 35.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.973 0.416 . . . . 0.0 110.015 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.813 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 16.2 m120 -71.49 100.32 2.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.422 -176.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.535 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 21.2 mmmt -127.24 149.66 49.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.386 177.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 61.7 p -75.21 165.58 24.98 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CZ3' ' HD2' ' A' ' 65' ' ' ARG . 68.4 t90 -56.81 -39.04 73.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.114 0.483 . . . . 0.0 110.276 -179.285 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.648 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -63.66 -50.88 67.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.91 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -64.84 -36.83 85.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.157 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.1 t -51.35 -47.82 62.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.189 174.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -74.82 -21.07 59.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.175 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 34.1 mmt-85 -82.7 -32.66 27.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.703 0.287 . . . . 0.0 111.339 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -83.32 -38.82 21.58 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.107 0.479 . . . . 0.0 109.916 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.577 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 96.8 m -85.68 177.8 7.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.798 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 35.7 m 76.88 -33.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.812 0.845 . . . . 0.0 110.511 -172.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.84 -32.75 84.91 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.394 -0.431 . . . . 0.0 112.471 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 pmm? -95.25 1.63 54.63 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.956 0.378 . . . . 0.0 110.448 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.03 -6.41 66.62 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.791 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.516 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.02 140.16 30.35 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.487 ' HD2' ' OD2' ' A' ' 77' ' ' ASP . 33.0 t60 -118.66 165.51 13.89 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.04 133.96 8.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.988 0.423 . . . . 0.0 111.552 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.815 ' HG2' ' HE2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -58.54 103.73 0.17 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.492 0.663 . . . . 0.0 111.03 178.876 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.651 ' HA ' ' HZ3' ' A' ' 75' ' ' TRP . 2.0 t -94.3 118.91 32.3 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.412 168.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.712 HD13 ' HE1' ' A' ' 39' ' ' MET . 25.3 mm -61.3 119.95 6.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.4 m -102.75 -45.45 5.0 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.0 p -136.98 163.08 31.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 111.244 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -64.88 -40.56 95.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.052 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.408 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.47 -45.48 90.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.195 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -54.15 -50.45 66.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.726 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -51.7 -50.36 60.65 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.638 176.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -66.26 -41.43 89.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.951 -177.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.408 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 26.1 m-85 -70.19 -41.29 73.89 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.3 tp -69.96 -34.07 58.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.548 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.44 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 33.8 pt -71.91 -3.26 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 120.885 0.374 . . . . 0.0 111.349 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -87.46 -23.96 24.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.416 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 72.9 m-85 -93.14 -21.21 19.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -73.89 142.48 46.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.5 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 15.1 t70 -67.97 119.61 12.9 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.444 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.3 mtt180 -71.33 60.61 0.3 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.449 0.468 . . . . 0.0 111.742 -177.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 1.9 ttp180 -162.54 -29.32 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.293 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -92.35 173.98 7.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.381 0.61 . . . . 0.0 111.948 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.6 p -122.0 129.51 52.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.145 174.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.677 ' HB3' HG13 ' A' ' 125' ' ' ILE . 68.0 m-85 -114.17 126.23 54.83 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 -173.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.643 ' HA ' HG12 ' A' ' 103' ' ' VAL . 38.7 m-85 -61.98 146.94 48.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.1 mt -113.64 176.77 4.89 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.468 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.92 6.18 67.59 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 115.764 1.066 . . . . 0.0 115.764 -169.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 64' ' ' LEU . 1.4 pt? -103.48 138.54 40.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 118.861 1.331 . . . . 0.0 110.894 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.423 ' HD2' ' CZ3' ' A' ' 24' ' ' TRP . 30.3 ttt180 -136.86 137.81 40.09 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.711 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 7.6 t0 -109.82 154.22 23.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 161.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 2.9 pt-20 -145.02 -1.79 0.83 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -167.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -157.32 26.22 0.3 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.96 45.76 20.68 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.52 0.676 . . . . 0.0 109.229 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 66' ' ' ASP . 35.9 mtmt -70.04 -47.29 62.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.104 -173.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.24 -26.76 8.35 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -173.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -89.14 100.06 12.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.092 -0.554 . . . . 0.0 109.615 176.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.537 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 92.1 m95 -70.97 142.83 51.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.579 0.704 . . . . 0.0 112.089 -175.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -140.47 120.12 13.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.699 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HZ3' ' HA ' ' A' ' 40' ' ' THR . 40.7 m95 -79.15 147.21 32.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.912 175.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.2 p -75.01 -13.21 15.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.504 0.669 . . . . 0.0 109.996 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 4.6 m-20 -90.07 18.99 5.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.049 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 47.1 tp60 76.53 -19.72 0.4 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.231 0.612 . . . . 0.0 111.403 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.9 m -55.73 127.42 67.41 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 120.986 0.422 . . . . 0.0 111.556 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -72.55 158.94 50.08 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.532 2.155 . . . . 0.0 110.464 170.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.537 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 64.0 t80 -64.49 117.88 7.97 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.685 -178.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.563 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -90.72 110.79 43.96 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.706 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.99 -20.69 33.44 Favored 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.521 2.147 . . . . 0.0 112.444 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -104.55 2.88 31.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.523 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.563 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 3.6 mmp_? -123.2 22.48 9.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.116 0.484 . . . . 0.0 110.001 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.486 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.6 p -99.52 140.75 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.174 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -124.15 74.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.82 0.343 . . . . 0.0 110.735 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -63.5 156.55 25.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.223 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.602 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 27.1 t-80 . . . . . 0 C--O 1.235 0.324 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.535 -172.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.8 t30 . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.143 0.497 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.507 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.464 ' CG2' HD21 ' A' ' 64' ' ' LEU . 2.1 m -88.74 147.7 5.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.218 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 61' ' ' PHE . 29.0 m -127.43 154.47 37.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.639 176.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.9 mt -82.87 102.96 11.99 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 170.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.33 142.29 22.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.802 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 91.6 t80 -91.33 114.29 26.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.741 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.518 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -151.3 122.55 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.055 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 61.31 47.41 6.95 Favored 'General case' 0 CA--C 1.518 -0.264 0 O-C-N 123.981 0.8 . . . . 0.0 110.017 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 13.6 t70 73.44 -28.3 0.19 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.936 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -97.7 130.31 44.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.78 0.8 . . . . 0.0 112.383 -171.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.444 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 88.1 m95 -79.42 148.81 31.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.462 171.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.602 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -177.09 177.15 1.29 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.394 0.434 . . . . 0.0 111.012 173.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.486 ' CZ3' HG23 ' A' ' 86' ' ' VAL . 8.9 m0 -78.97 134.74 36.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.936 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -136.19 137.65 41.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -79.89 125.04 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.043 0.449 . . . . 0.0 111.343 -177.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.47 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 23.0 m -143.91 160.12 51.0 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.643 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.568 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 15.9 Cg_endo -58.58 140.36 94.45 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.096 1.864 . . . . 0.0 111.365 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.02 -23.71 61.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.808 0.337 . . . . 0.0 110.497 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -94.66 53.21 1.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.53 0.681 . . . . 0.0 110.273 174.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.568 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 66.8 t80 -123.64 125.64 45.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.309 176.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.813 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 1.8 mp0 -68.75 109.3 3.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.974 0.416 . . . . 0.0 110.98 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.465 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -142.52 -177.94 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.877 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 37.9 m -80.53 172.21 14.05 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.789 0.328 . . . . 0.0 110.347 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.506 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 12.3 ptt180 -149.65 148.98 29.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.128 0.49 . . . . 0.0 112.101 -171.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.677 HG13 ' HB3' ' A' ' 60' ' ' TYR . 19.2 mt -119.79 121.55 66.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 173.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 87.5 m -112.62 126.32 55.24 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.265 0.555 . . . . 0.0 110.119 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -112.16 124.93 53.5 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.471 -173.677 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.516 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 18.4 tt -106.8 144.2 28.59 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.896 -178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HG13 ' A' ' 128' ' ' ILE . 7.9 Cg_endo -54.97 166.03 2.36 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.796 2.331 . . . . 0.0 112.503 172.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -64.53 89.97 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.548 173.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.6 p -61.21 2.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.446 ' H ' ' C ' ' A' ' 130' ' ' GLY . 15.1 t -75.18 -5.1 42.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.618 179.095 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.4 mp -85.26 -26.31 26.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.701 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -88.91 -50.32 6.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -92.45 35.46 1.02 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.347 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.688 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -72.36 -67.99 0.51 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.443 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.688 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 3.8 p30 -86.81 -22.57 25.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 5.4 tt -55.64 -55.72 28.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -75.0 -19.76 59.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.216 0.531 . . . . 0.0 109.964 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.87 -31.51 70.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.043 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 81.6 mm-40 -86.19 -38.63 17.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.621 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.105 -177.211 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.9 m . . . . . 0 C--O 1.233 0.188 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 42.9 Cg_exo -57.85 152.24 51.43 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.845 1.697 . . . . 0.0 110.979 168.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 15.4 tt -74.61 -18.72 16.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.069 0.461 . . . . 0.0 111.681 -171.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -74.57 -32.19 62.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 34.9 m95 -72.67 128.19 34.82 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 2.0 tpp180 -84.1 121.1 26.97 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.446 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.62 138.76 31.22 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.113 0.482 . . . . 0.0 111.972 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.452 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 84.5 t80 -131.53 102.44 5.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.189 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 58.78 -96.51 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.707 -174.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.0 t -105.81 -12.08 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.691 -178.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -93.54 164.49 13.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.697 0.284 . . . . 0.0 111.356 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.9 m -144.12 131.52 20.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.229 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.452 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 2.9 m-85 -123.5 134.77 53.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 -175.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 34.5 t80 -124.62 115.43 26.8 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 174.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -82.57 120.19 3.13 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.13 2.553 . . . . 0.0 112.24 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.653 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -99.29 139.12 35.42 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.995 0.426 . . . . 0.0 110.228 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.0 p -94.43 -3.29 50.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.41 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -65.68 135.68 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.912 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.19 120.75 29.84 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.1 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 43.1 mmtm -144.25 150.97 38.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.363 177.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 119' ' ' ASN . 0.0 OUTLIER -68.96 158.94 33.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 167.098 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.417 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 82.5 t90 -52.48 -47.26 66.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.705 0.288 . . . . 0.0 111.358 -175.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.14 93.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.274 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.64 -27.13 63.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.955 0.407 . . . . 0.0 110.816 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.8 t -62.52 -43.95 97.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.18 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.562 ' OE2' HG11 ' A' ' 76' ' ' VAL . 8.7 tp10 -79.21 -21.39 46.35 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.311 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.32 -31.13 69.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.987 173.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.414 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.5 t-20 -85.41 -28.26 25.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.432 0.634 . . . . 0.0 109.742 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.459 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 80.9 m -84.61 -179.9 7.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 170.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 72.5 m 73.56 -45.79 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.755 0.422 . . . . 0.0 111.193 -175.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.08 -27.6 70.74 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.66 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 75.3 mtm -92.74 7.37 43.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.806 0.336 . . . . 0.0 110.472 176.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.69 -6.28 70.47 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.367 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.779 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.79 -177.71 3.99 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.538 0.209 . . . . 0.0 111.318 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -148.53 169.76 19.57 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.773 0.429 . . . . 0.0 110.009 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.455 ' HB2' HG21 ' A' ' 76' ' ' VAL . 3.7 mm? -55.0 143.65 25.85 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.068 0.23 . . . . 0.0 110.496 173.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.3 tpt -49.6 109.6 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.654 0.596 . . . . 0.0 111.884 -177.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.65 HG22 ' HB3' ' A' ' 75' ' ' TRP . 27.3 p -107.92 106.76 17.17 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.326 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.9 mt -81.62 116.13 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.932 -176.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.3 p -102.89 -31.56 10.2 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.04 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.6 p -131.16 159.44 37.68 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.522 0.677 . . . . 0.0 111.904 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' HE ' ' A' ' 85' ' ' ARG . 19.8 mt-10 -68.42 -39.41 81.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.711 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.26 -33.52 74.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.597 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -58.84 -50.35 74.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.164 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.43 ' O ' HG23 ' A' ' 51' ' ' ILE . 34.3 tt0 -57.63 -55.44 34.76 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 35.2 m-80 -59.17 -36.96 76.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.069 -175.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -69.49 -47.22 64.57 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 121.278 -0.169 . . . . 0.0 111.106 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.452 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 8.8 tp -70.59 -33.98 55.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.011 0.434 . . . . 0.0 111.58 -174.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.806 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.9 pt -71.06 -11.19 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.946 0.403 . . . . 0.0 110.938 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 75.4 mt-30 -76.91 -27.55 54.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.634 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.452 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 55.1 m-85 -90.14 -21.77 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.596 -179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.43 150.07 40.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.262 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -67.84 -13.48 62.17 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.701 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 49.5 mtp180 66.84 30.55 7.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.911 0.386 . . . . 0.0 111.099 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.635 ' HB3' HD22 ' A' ' 58' ' ' LEU . 3.7 ttm180 -132.21 -56.36 0.97 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.832 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 57' ' ' ARG . 2.7 mm? -83.27 170.96 14.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.453 -174.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -111.82 125.72 54.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.468 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.594 ' HB3' HG13 ' A' ' 125' ' ' ILE . 21.3 m-85 -108.76 126.52 53.11 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -171.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.44 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.7 m-85 -60.54 149.94 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.758 ' HB2' HG13 ' A' ' 102' ' ' VAL . 90.4 mt -120.91 -178.93 3.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.298 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.538 ' CA ' HG23 ' A' ' 76' ' ' VAL . . . -81.86 -17.94 68.97 Favored Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.749 -0.738 . . . . 0.0 114.193 -176.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.621 ' HB2' ' CG1' ' A' ' 102' ' ' VAL . 83.7 mt -71.78 121.53 19.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 117.666 0.733 . . . . 0.0 110.455 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 ptm85 -129.19 161.76 29.4 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.597 0.713 . . . . 0.0 112.32 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.672 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 1.8 t70 -135.61 151.52 50.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.676 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.986 ' HG2' ' HD2' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -112.07 -33.51 6.23 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.881 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -161.42 71.3 0.38 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.251 -172.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.81 36.43 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.041 0.448 . . . . 0.0 111.449 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.986 ' HD2' ' HG2' ' A' ' 67' ' ' GLU . 32.3 mtpt -63.03 127.86 33.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.451 -177.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.65 -14.64 82.21 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.118 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 24.8 pt20 -107.8 113.64 27.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.276 0.56 . . . . 0.0 110.251 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.548 ' HB3' HD22 ' A' ' 64' ' ' LEU . 44.9 m95 -99.33 158.65 15.56 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.779 -178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.509 ' HG2' ' N ' ' A' ' 75' ' ' TRP . 3.6 ttt180 -152.04 149.38 28.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.537 176.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.65 ' HB3' HG22 ' A' ' 40' ' ' THR . 82.4 m95 -82.74 -174.65 5.35 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.568 0.542 . . . . 0.0 109.756 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.562 HG11 ' OE2' ' A' ' 28' ' ' GLU . 35.5 t -81.82 -65.09 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.89 -77.88 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.42 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.0 OUTLIER -153.61 -18.07 0.14 Allowed 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.42 ' H ' ' H ' ' A' ' 78' ' ' GLN . 16.8 m -57.03 118.24 22.76 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.875 -176.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.33 169.71 20.12 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.042 2.495 . . . . 0.0 111.542 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 77.1 t80 -60.49 137.45 58.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 110.001 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -97.24 118.86 64.14 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.784 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.51 -46.61 20.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.327 2.685 . . . . 0.0 113.879 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -85.5 -31.51 22.72 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.589 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -92.08 80.03 5.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 110.133 -176.256 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.0 t -128.61 103.87 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.507 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -127.35 67.51 1.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.338 -173.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.512 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 86.1 m95 -84.93 -166.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.855 0.359 . . . . 0.0 110.595 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.616 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 69.1 m-70 . . . . . 0 CA--C 1.514 -0.404 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 66' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--O 1.224 -0.243 0 CA-C-O 121.544 0.688 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.3 m -102.45 139.66 37.77 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.758 HG13 ' HB2' ' A' ' 62' ' ' LEU . 13.8 p -91.53 145.68 7.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -169.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.44 HG12 ' HA ' ' A' ' 61' ' ' PHE . 19.8 m -128.84 155.28 40.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.595 174.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD11 ' A' ' 62' ' ' LEU . 23.1 mt -88.35 118.92 28.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 171.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -130.37 141.62 45.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.42 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -75.64 108.37 8.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.703 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.426 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.9 t-20 -159.08 143.18 15.3 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -177.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 66.73 35.33 5.19 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.314 0.578 . . . . 0.0 109.748 -173.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.69 4.11 4.85 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 114.548 -1.206 . . . . 0.0 112.691 174.418 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.5 175.44 10.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.882 0.372 . . . . 0.0 110.288 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.806 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 82.2 m95 -85.69 137.64 32.68 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 173.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.616 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -154.93 174.22 15.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.481 176.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.512 ' HB2' ' HA ' ' A' ' 88' ' ' TRP . 51.9 m0 -81.04 136.5 35.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.522 -172.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -129.93 130.07 44.64 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.112 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.82 123.92 27.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.193 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.24 158.63 63.72 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.529 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.43 135.89 67.51 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.332 2.021 . . . . 0.0 111.018 171.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -27.39 66.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.762 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASN . . . . . 0.445 ' HA ' HG22 ' A' ' 23' ' ' THR . 3.8 p30 -86.67 60.34 6.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.824 0.821 . . . . 0.0 110.639 175.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -137.25 116.78 12.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.059 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -63.1 117.98 7.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.071 0.462 . . . . 0.0 111.632 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.412 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -144.39 -176.39 5.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.89 176.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.3 m -78.51 171.82 14.56 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.653 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -152.45 135.66 15.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -167.931 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.594 HG13 ' HB3' ' A' ' 60' ' ' TYR . 67.6 mt -105.85 127.45 60.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 172.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.74 121.95 45.75 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -112.28 129.2 56.36 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.897 -175.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.779 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.2 tt -129.87 141.13 40.78 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -70.9 166.8 27.84 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.087 1.858 . . . . 0.0 110.57 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.38 57.74 1.57 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.964 176.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -106.07 17.52 23.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.078 0.466 . . . . 0.0 110.98 -173.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 m -61.05 -20.08 62.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.148 0.499 . . . . 0.0 111.228 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.47 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.0 mp -79.84 -26.94 40.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.668 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -88.04 -37.54 16.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.221 0.534 . . . . 0.0 109.91 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.14 40.56 0.99 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.738 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.488 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.58 -57.36 11.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.986 -174.421 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.488 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 9.3 m-80 -74.26 -24.03 59.22 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.75 0.309 . . . . 0.0 110.625 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.97 -51.68 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -70.74 -23.52 62.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.394 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -70.88 -31.72 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.547 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -89.03 -6.37 57.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.456 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.833 -177.314 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB2' HG21 ' A' ' 132' ' ' THR . 72.8 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.981 0.419 . . . . 0.0 112.052 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.88 169.17 19.69 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.829 2.352 . . . . 0.0 110.915 171.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.5 pt -72.27 -18.51 19.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.92 -49.49 70.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.985 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.506 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 25.2 m95 -62.05 139.24 58.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.889 178.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 14.1 mmm180 -84.71 129.51 34.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 111.315 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.37 121.46 42.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.933 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.48 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.4 t80 -121.41 105.16 10.25 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 69.55 -61.98 0.43 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.009 0.818 . . . . 0.0 110.956 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.8 m -152.31 -25.83 0.17 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.795 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -82.9 156.46 23.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -175.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.623 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 23.5 m -120.05 137.71 53.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.134 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.48 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 16.7 m-85 -131.8 135.15 46.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.651 0.262 . . . . 0.0 110.72 -175.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.506 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 41.5 t80 -134.17 117.16 13.5 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.128 175.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -84.65 129.31 4.15 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.727 2.285 . . . . 0.0 112.258 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -104.75 139.35 39.68 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.835 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.5 p -105.53 3.31 29.26 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.214 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -88.08 137.2 32.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.658 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 94.5 m-20 -74.51 122.97 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.279 0.561 . . . . 0.0 111.587 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.596 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 43.7 mmtm -141.19 151.31 43.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.01 175.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 63.5 p -73.07 170.44 14.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 172.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.65 ' HZ3' ' HE ' ' A' ' 65' ' ' ARG . 20.8 t90 -62.6 -35.93 81.11 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.285 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.595 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -62.76 -51.62 66.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.55 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.596 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 11.0 mm-40 -61.53 -34.65 75.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.777 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.575 ' HB3' HD11 ' A' ' 38' ' ' LEU . 56.4 m -64.9 -45.07 87.46 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.367 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 17.2 pt-20 -73.74 -24.92 59.96 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.07 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.5 mtm180 -78.63 -49.67 12.82 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.874 0.369 . . . . 0.0 111.166 177.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.32 -31.53 71.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' SER . 1.3 t -84.52 177.94 7.9 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 172.005 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 20.6 m 76.88 -46.54 0.51 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 122.506 0.322 . . . . 0.0 110.675 -176.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.63 -33.15 75.95 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 121.221 -0.514 . . . . 0.0 111.937 174.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -79.57 2.07 23.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.849 0.356 . . . . 0.0 110.745 176.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.13 47.85 17.03 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.658 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -148.54 -177.41 5.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -150.64 169.52 21.38 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 173.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.643 ' HB2' HG21 ' A' ' 76' ' ' VAL . 4.1 mm? -57.18 138.8 54.16 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 171.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.411 ' CE ' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -48.88 108.64 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.844 0.715 . . . . 0.0 112.325 -173.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -93.33 88.97 6.18 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.723 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.411 HG12 ' CE ' ' A' ' 39' ' ' MET . 48.2 mt -57.17 111.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.083 -176.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.1 m -93.0 -32.7 14.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.78 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 2.9 t -138.75 153.85 48.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.0 112.128 -177.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' NH1' ' A' ' 85' ' ' ARG . 23.0 mt-10 -61.5 -35.26 77.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.79 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -63.58 -34.94 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.224 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.493 ' HB3' ' O ' ' A' ' 43' ' ' THR . 57.8 tt0 -61.0 -51.41 69.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.316 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' HA ' HG22 ' A' ' 50' ' ' ILE . 50.6 tt0 -62.51 -40.35 96.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.064 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.99 -27.86 69.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 20.8 m-85 -88.3 -34.28 17.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.608 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -69.05 -33.39 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.861 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.5 pt -71.29 -4.45 4.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.86 0.362 . . . . 0.0 111.141 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.93 -27.46 26.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.717 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -89.91 -27.03 20.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.385 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.3 mt -74.89 129.45 37.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.168 -176.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.411 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.8 t70 -57.17 125.85 24.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.753 174.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.428 ' HG2' ' HE1' ' A' ' 111' ' ' TRP . 18.0 mtp180 -75.15 59.23 0.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.578 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.532 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -161.9 -30.93 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.724 177.379 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.532 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -84.26 172.62 11.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.0 -178.424 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 m -122.38 122.73 39.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.26 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB3' HG13 ' A' ' 125' ' ' ILE . 70.6 m-85 -110.37 122.04 46.74 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -170.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.583 ' HA ' HG12 ' A' ' 103' ' ' VAL . 39.6 m-85 -60.49 130.54 47.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.964 0.411 . . . . 0.0 111.361 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.516 HD21 ' HB2' ' A' ' 104' ' ' LEU . 95.7 mt -99.95 174.37 6.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.197 178.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.495 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.75 47.95 3.9 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.322 -177.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.32 126.97 49.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.705 0.253 . . . . 0.0 110.359 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.65 ' HE ' ' HZ3' ' A' ' 24' ' ' TRP . 8.1 ttm180 -124.61 124.12 41.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 176.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.476 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 39.1 t0 -116.96 153.72 32.13 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 163.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.677 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 27.9 tt0 -146.87 108.58 4.34 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.278 -168.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 18.2 m120 68.53 23.83 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.744 0.653 . . . . 0.0 110.674 -179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.476 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 62.27 84.74 0.13 Allowed 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.985 0.803 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HZ3' ' HB3' ' A' ' 67' ' ' GLU . 64.7 mttp -100.02 157.25 16.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.331 177.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -84.71 -12.34 75.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.094 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -123.8 102.34 7.75 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.338 0.589 . . . . 0.0 110.415 178.241 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 11.7 m0 -78.51 167.91 20.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.272 178.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.612 ' NH2' ' HA ' ' A' ' 78' ' ' GLN . 43.8 ttt-85 -144.11 143.6 31.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.277 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.495 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 67.7 m95 -78.75 167.17 21.59 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 38' ' ' LEU . 69.4 t -60.06 -50.44 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.782 0.325 . . . . 0.0 110.999 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -96.94 77.79 2.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.964 0.411 . . . . 0.0 111.383 -174.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.612 ' HA ' ' NH2' ' A' ' 74' ' ' ARG . 44.5 tp60 69.36 -48.59 0.6 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 169.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 24.1 m -48.69 126.74 13.48 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 122.861 0.464 . . . . 0.0 112.083 -173.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 5.2 Cg_exo -76.6 166.33 27.42 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.979 2.453 . . . . 0.0 111.776 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.563 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 84.1 t80 -53.82 132.79 42.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.14 0.495 . . . . 0.0 110.998 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -112.73 112.78 50.63 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.498 -175.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -67.43 -16.17 47.05 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.181 2.587 . . . . 0.0 112.929 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.411 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.5 tpp180 -100.48 -20.42 15.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.432 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.469 ' NH1' ' HG3' ' A' ' 44' ' ' GLU . 8.6 tpp180 -114.28 70.49 0.73 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.53 0.681 . . . . 0.0 110.11 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.1 p -151.27 142.07 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.754 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -118.3 -37.88 3.27 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.882 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.462 ' O ' ' HB1' ' A' ' 112' ' ' ALA . 99.3 m95 59.11 -165.02 0.2 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.139 -174.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.562 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 12.0 t-80 . . . . . 0 C--O 1.237 0.424 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.031 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 122.002 0.906 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 97.5 m -110.28 121.99 46.6 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.878 177.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 35.3 m -74.4 136.49 25.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.311 0.577 . . . . 0.0 111.442 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.583 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.8 m -116.89 154.93 18.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.609 176.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.516 ' HB2' HD21 ' A' ' 62' ' ' LEU . 13.8 tp -83.59 100.86 11.08 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -120.18 143.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.433 0.635 . . . . 0.0 111.784 -171.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 56' ' ' ARG . 65.5 t80 -83.61 97.03 8.85 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.76 176.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.522 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -143.83 131.48 21.25 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 85.6 mt-30 66.62 29.34 8.9 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 123.824 0.703 . . . . 0.0 109.302 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 t70 72.82 -14.61 0.57 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.625 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -108.23 138.73 44.02 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.394 0.616 . . . . 0.0 111.245 -176.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.428 ' HE1' ' HG2' ' A' ' 56' ' ' ARG . 92.8 m95 -74.68 131.83 41.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.14 176.091 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.562 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -160.78 167.36 26.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.765 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 14.7 m0 -80.2 121.46 25.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.785 -177.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -123.83 130.89 53.34 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.531 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.09 125.02 25.77 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.8 m -137.2 159.49 69.51 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.201 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.6 134.99 47.95 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.054 1.836 . . . . 0.0 110.577 172.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.0 m -69.17 -35.43 76.29 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.805 0.336 . . . . 0.0 110.364 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASN . . . . . 0.519 ' HA ' ' HB ' ' A' ' 23' ' ' THR . 5.6 t30 -85.49 72.55 10.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.594 0.712 . . . . 0.0 109.412 170.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 23' ' ' THR . 84.9 t80 -137.85 131.59 31.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.95 -1.023 . . . . 0.0 108.798 176.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 26.0 mp0 -75.28 110.15 9.38 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.979 0.419 . . . . 0.0 110.878 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.513 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -146.76 -177.25 5.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.199 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 16.1 m -79.37 173.98 12.03 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.729 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 13.4 ptt180 -154.65 158.84 40.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.818 0.342 . . . . 0.0 111.686 -171.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.598 HG13 ' HB3' ' A' ' 60' ' ' TYR . 49.3 mt -127.17 126.6 68.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.874 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 17.9 m -103.09 131.57 49.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 174.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -119.2 131.31 55.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.032 -176.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.623 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 81.1 mt -107.81 134.23 20.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.126 173.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -67.01 166.33 23.26 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.215 1.943 . . . . 0.0 111.344 177.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.09 54.61 1.44 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.132 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 8.9 t -99.14 -19.06 17.37 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.816 -0.226 . . . . 0.0 110.897 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.456 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 4.4 t -65.93 -37.08 85.12 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 91.0 mt -58.83 -33.61 70.6 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.069 0.461 . . . . 0.0 111.27 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -81.61 -31.25 32.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.306 0.574 . . . . 0.0 109.678 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.51 7.8 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.052 -177.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 133' ' ' LEU . 50.6 mm-40 -62.88 -38.1 89.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 8.7 t30 -69.44 -32.95 72.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.975 176.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.28 -43.84 85.23 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -71.83 -20.75 61.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -68.93 -30.73 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.409 0.623 . . . . 0.0 109.635 173.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 80.3 mt-30 -86.53 -41.26 14.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.985 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.665 -177.88 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 m . . . . . 0 CA--C 1.519 -0.244 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -57.25 146.89 79.79 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.01 1.806 . . . . 0.0 110.994 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.86 -27.8 28.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.195 0.521 . . . . 0.0 110.753 -174.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -71.61 -34.88 70.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.079 176.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -69.88 141.86 53.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.679 ' HD3' ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -91.41 112.16 23.95 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.715 -174.901 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.79 133.53 35.12 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.022 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 79.1 t80 -138.68 102.57 4.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.977 178.218 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 63.74 -81.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.966 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.0 m -135.88 12.77 3.39 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.922 0.391 . . . . 0.0 110.986 -176.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -128.02 158.14 38.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.238 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 75.4 m -136.32 127.76 28.52 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 0.0 110.093 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 13.2 m-85 -118.54 138.49 52.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.383 -173.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -118.63 112.81 36.79 Favored Pre-proline 0 C--N 1.318 -0.789 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.884 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -89.8 121.56 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.197 2.598 . . . . 0.0 112.336 178.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.807 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.1 mm? -107.74 138.89 43.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.085 0.469 . . . . 0.0 110.884 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 p -90.87 -5.41 55.58 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.886 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.03 130.35 46.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.201 -1.363 . . . . 0.0 111.201 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -80.49 112.02 17.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.214 -175.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.654 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 39.2 mmtm -143.49 151.15 39.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.866 178.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 43.1 p -74.74 172.21 12.55 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 70.0 t90 -57.04 -41.53 78.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.091 0.472 . . . . 0.0 110.607 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -67.29 -45.19 77.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.397 -178.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 42.8 mt-10 -64.48 -36.63 84.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.46 -177.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -56.69 -44.71 81.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.761 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -79.53 -21.52 45.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.584 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 96.7 mtt180 -69.65 -40.15 76.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.895 0.379 . . . . 0.0 110.766 176.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -78.21 -31.23 49.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.346 0.593 . . . . 0.0 110.151 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 89.0 m -86.89 179.52 6.71 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.324 174.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 70.1 m 74.02 -40.15 0.45 Allowed 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.493 0.717 . . . . 0.0 110.472 -172.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.94 73.6 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 170.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.9 mtm -92.88 7.04 45.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.825 0.345 . . . . 0.0 110.542 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.05 -14.64 48.22 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.664 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' CYS . . . -95.32 141.69 28.6 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.775 -0.25 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.555 ' CD2' HG13 ' A' ' 76' ' ' VAL . 19.9 t60 -118.31 150.52 39.35 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.3 mp -44.77 131.61 6.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.909 0.385 . . . . 0.0 111.929 -175.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.8 ttt -54.0 117.75 3.46 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.736 -169.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.575 HG21 ' OD1' ' A' ' 77' ' ' ASP . 19.2 p -104.79 97.07 7.01 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.22 174.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.09 113.17 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.408 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 m -94.66 -35.43 12.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.659 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 1.8 t -131.31 151.52 51.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.667 0.746 . . . . 0.0 111.887 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -59.83 -35.96 75.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.961 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.462 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.84 -41.06 97.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.997 0.427 . . . . 0.0 110.206 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.4 tt0 -55.02 -50.75 68.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.984 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.45 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.9 tt0 -65.57 -49.24 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 178.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -59.33 -28.07 66.49 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -175.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.462 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 23.8 m-85 -85.97 -42.79 13.71 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.655 178.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.3 tp -68.17 -30.51 48.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.203 -175.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.642 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.0 pt -73.41 -2.64 3.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.479 -177.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -87.62 -23.12 24.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.826 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.679 ' CE1' ' HD3' ' A' ' 8' ' ' ARG . 83.1 m-85 -95.78 -24.95 16.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.602 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -69.51 141.92 53.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.286 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 13.7 t70 -70.03 117.5 11.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.536 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 80.6 mtt180 -76.34 55.79 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.302 0.572 . . . . 0.0 111.405 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 4.2 ttp180 -154.16 -32.68 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.22 152.78 18.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.054 0.454 . . . . 0.0 111.196 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 p -102.0 122.8 44.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.657 173.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.555 ' HB3' HG13 ' A' ' 125' ' ' ILE . 82.7 m-85 -102.25 127.57 49.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.369 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.557 ' HA ' HG12 ' A' ' 103' ' ' VAL . 26.6 m-85 -65.35 139.32 58.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.928 0.394 . . . . 0.0 111.577 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' A' ' 104' ' ' LEU . 86.2 mt -111.69 172.81 6.67 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.324 176.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -77.51 -5.36 85.86 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.535 -177.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.566 HD11 ' HB3' ' A' ' 73' ' ' TRP . 28.6 tp -73.68 115.65 13.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.266 0.533 . . . . 0.0 110.113 -178.45 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 67' ' ' GLU . 21.4 ttm180 -113.04 144.05 43.26 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.394 -172.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.494 ' N ' ' HG2' ' A' ' 65' ' ' ARG . 11.3 t0 -129.69 127.07 39.76 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 153.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 65' ' ' ARG . 1.0 OUTLIER -105.89 14.38 28.12 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -172.211 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.544 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -163.95 17.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.93 178.427 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.33 40.13 31.49 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.502 0.668 . . . . 0.0 109.844 -174.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.653 ' HE2' ' HB2' ' A' ' 72' ' ' GLN . 14.2 mtmm -71.53 -24.9 62.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.736 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.26 6.7 70.86 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -174.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.653 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . 74.0 mt-30 -117.66 90.22 3.29 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.473 -178.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.566 ' HB3' HD11 ' A' ' 64' ' ' LEU . 98.6 m95 -72.26 129.92 39.57 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.167 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 62.8 mtm180 -132.48 142.7 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.437 ' CE3' HG22 ' A' ' 40' ' ' THR . 98.2 m95 -74.16 169.91 16.6 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.886 0.374 . . . . 0.0 110.452 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.555 HG13 ' CD2' ' A' ' 37' ' ' HIS . 12.7 p -78.78 -3.4 5.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.175 0.512 . . . . 0.0 111.723 -170.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.575 ' OD1' HG21 ' A' ' 40' ' ' THR . 3.4 p-10 -98.89 -80.79 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 175.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.473 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 0.9 OUTLIER -160.14 -23.77 0.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.006 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.6 m -54.53 130.49 63.17 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.805 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 2.9 Cg_exo -77.15 165.78 27.5 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.903 2.402 . . . . 0.0 111.536 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.582 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 91.4 t80 -58.27 132.33 53.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.003 0.43 . . . . 0.0 110.692 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.547 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 0.8 OUTLIER -85.5 122.85 73.38 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.059 -176.862 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -60.99 -18.42 57.5 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.853 2.369 . . . . 0.0 113.359 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 84' ' ' ARG . 38.6 mtt180 -113.34 16.96 18.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 111.35 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.547 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 19.8 mmt180 -120.57 80.24 1.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 171.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.5 t -126.81 105.04 13.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.032 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.45 96.14 4.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.875 -177.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -121.21 -173.63 2.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.934 0.397 . . . . 0.0 110.625 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 95.4 m-70 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.9 t30 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.46 152.98 46.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.236 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.614 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 27.5 m -98.36 140.62 17.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.236 0.541 . . . . 0.0 111.209 179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.557 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.2 m -122.96 153.1 27.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 174.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' A' ' 62' ' ' LEU . 15.0 mt -82.89 110.58 18.01 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 173.434 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.7 p -123.56 136.98 58.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.683 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 58.0 t80 -82.06 96.15 7.67 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.353 176.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 108' ' ' GLN . 27.0 t-20 -143.89 135.33 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 52.4 mt-30 67.87 27.67 7.24 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -173.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 59.55 17.79 6.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.295 -1.321 . . . . 0.0 112.699 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -130.8 136.23 48.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.004 0.43 . . . . 0.0 110.251 175.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.642 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 80.0 m95 -76.65 104.45 7.16 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.683 175.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -137.83 160.99 37.78 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.215 -178.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.614 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 25.0 m0 -72.91 149.45 43.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -176.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -137.37 131.19 31.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.364 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.35 123.74 21.58 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 123.655 0.597 . . . . 0.0 110.547 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 18.6 m -146.52 151.66 43.77 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.586 177.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.69 135.53 62.45 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.201 1.934 . . . . 0.0 110.683 172.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 46.6 m -67.67 -20.6 65.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.916 0.389 . . . . 0.0 110.579 -176.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -91.43 66.72 5.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.464 0.65 . . . . 0.0 109.305 173.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -137.67 114.4 10.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.824 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.02 109.87 1.62 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.114 0.483 . . . . 0.0 110.826 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.462 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -143.54 -171.19 3.46 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.964 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 57.3 m -82.52 173.06 12.32 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.807 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -150.48 152.94 35.0 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -167.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.555 HG13 ' HB3' ' A' ' 60' ' ' TYR . 55.9 mt -136.97 131.41 46.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.96 177.305 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 90.2 m -120.24 143.89 48.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.184 0.516 . . . . 0.0 110.688 176.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -120.44 129.79 54.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.294 -0.867 . . . . 0.0 111.043 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.6 tt -124.22 144.89 46.83 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.93 156.49 43.69 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 121.7 1.6 . . . . 0.0 110.48 169.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -62.8 -11.09 35.03 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.003 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 58.5 p 62.96 -14.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.803 1.241 . . . . 0.0 113.501 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.654 ' HB ' ' HG2' ' A' ' 136' ' ' GLU . 23.1 p -79.16 -3.1 43.99 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.908 ' H ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -54.36 -33.64 59.51 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.303 172.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.652 ' H ' HD22 ' A' ' 133' ' ' LEU . 51.4 t-20 -90.89 -44.07 9.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.266 168.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.575 ' HB3' ' HA ' ' A' ' 132' ' ' THR . . . -86.24 0.83 52.86 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -164.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.654 ' HG2' ' HB ' ' A' ' 132' ' ' THR . 5.1 mm-40 -68.71 -44.63 73.49 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.503 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 44.2 t30 -71.48 -34.8 70.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.013 176.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.58 -46.45 89.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -66.01 -31.02 71.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.171 177.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.54 -42.54 67.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.212 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.5 mm-40 -78.05 -14.7 59.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.726 -175.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.346 -178.55 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.638 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.6 m . . . . . 0 C--O 1.234 0.279 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.638 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 81.7 Cg_exo -48.48 150.2 6.03 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 121.828 1.685 . . . . 0.0 111.655 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.07 -17.17 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -169.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -78.75 -33.0 46.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.069 0.461 . . . . 0.0 109.964 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.458 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 76.2 m95 -79.92 115.78 19.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.6 tpt180 -72.81 104.67 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.214 0.53 . . . . 0.0 110.358 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.2 133.27 42.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.198 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -134.73 102.24 5.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.411 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.73 -82.89 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.554 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.6 m -133.49 2.38 3.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.821 0.344 . . . . 0.0 111.389 -177.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -117.79 162.9 17.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.8 m -137.98 133.43 33.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.807 0.337 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -127.12 127.9 45.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.716 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.506 ' CD2' HD22 ' A' ' 18' ' ' LEU . 49.2 t80 -104.11 113.23 65.46 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 8.5 Cg_endo -89.96 119.41 0.81 Allowed 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 123.537 2.824 . . . . 0.0 111.597 174.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.506 HD22 ' CD2' ' A' ' 16' ' ' PHE . 1.1 pt? -135.31 140.57 45.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.448 0.642 . . . . 0.0 110.821 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 34.0 p -101.54 17.71 22.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.92 -172.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -73.23 141.37 47.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 18.5 m120 -67.8 118.7 11.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.571 -178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.89 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 2.3 mmpm? -159.89 146.91 16.38 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.582 0.753 . . . . 0.0 109.519 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.491 HG23 ' OE2' ' A' ' 121' ' ' GLU . 58.1 p -82.32 177.83 8.56 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.218 178.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 84.0 t90 -61.02 -45.68 93.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.91 82.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.595 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.89 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 21.9 mm-40 -63.6 -38.48 91.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.46 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.526 ' OG ' HD13 ' A' ' 38' ' ' LEU . 34.3 t -60.65 -48.66 80.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.803 0.335 . . . . 0.0 110.247 177.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -66.73 -27.02 67.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.67 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -82.83 -46.18 13.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.136 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -69.84 -35.52 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.521 0.677 . . . . 0.0 109.959 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 32' ' ' SER . 69.1 m -87.97 179.5 6.42 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.204 171.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.832 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 63.4 m 78.98 -43.39 0.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 122.905 0.482 . . . . 0.0 110.62 -174.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.82 -14.49 63.13 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.782 172.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.5 mtm -98.61 11.61 37.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.586 0.231 . . . . 0.0 110.9 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.12 -2.24 87.9 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.926 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.832 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -98.38 -173.88 2.68 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.683 0.393 . . . . 0.0 110.208 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CD2' HG13 ' A' ' 76' ' ' VAL . 4.5 t60 -149.19 155.32 40.46 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.526 HD13 ' OG ' ' A' ' 27' ' ' SER . 23.1 tp -56.37 131.51 48.47 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 125' ' ' ILE . 21.4 ttt -50.46 125.78 13.62 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -168.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 16.9 p -118.18 102.67 9.18 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.377 176.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -73.29 112.67 9.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.646 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.9 t -102.91 -29.68 11.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.513 -177.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 71.0 p -123.3 151.39 42.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.555 0.693 . . . . 0.0 112.049 -175.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -63.1 -40.2 96.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.102 179.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.41 -38.58 90.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.589 177.689 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 43' ' ' THR . 88.7 tt0 -54.85 -50.77 67.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.882 175.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.599 HE22 ' HE1' ' A' ' 113' ' ' TRP . 5.8 tp-100 -59.16 -53.87 53.46 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 177.011 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.257 -175.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.587 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 47.5 m-85 -88.33 -18.66 27.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -175.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.1 tp -82.49 -31.97 10.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.272 -0.571 . . . . 0.0 111.153 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.1 pt -67.9 -9.39 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 30.2 pt20 -86.44 -21.67 26.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.842 0.353 . . . . 0.0 110.561 177.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -89.72 -30.04 18.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.055 0.455 . . . . 0.0 109.934 178.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 52.6 mt -68.84 147.27 51.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.002 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.466 ' HB3' HD23 ' A' ' 58' ' ' LEU . 14.7 t70 -85.09 131.77 34.41 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.401 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.7 mtt85 -78.03 14.47 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.314 -170.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 ttm-85 -105.86 -26.31 11.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.783 0.325 . . . . 0.0 110.726 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' A' ' 55' ' ' ASP . 3.1 mm? -98.51 175.24 6.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.519 0.676 . . . . 0.0 112.119 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.4 m -128.96 122.97 31.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.105 -0.952 . . . . 0.0 108.828 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -108.21 122.88 47.84 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -172.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.453 ' CD2' ' HB3' ' A' ' 122' ' ' ALA . 6.6 m-85 -67.38 140.49 57.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.81 HD11 ' HG ' ' A' ' 104' ' ' LEU . 93.4 mt -121.75 155.81 34.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.234 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.82 44.68 2.81 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.228 -0.51 . . . . 0.0 114.318 -172.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.495 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.7 tp -100.5 115.84 31.05 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -116.91 119.7 36.18 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -167.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.54 154.67 17.14 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 160.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.677 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.9 tt0 -137.74 86.63 2.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.026 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 71.94 36.3 1.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.319 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.34 67.21 0.74 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.672 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 53.0 mttp -94.78 -23.04 17.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.774 178.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.26 -19.93 12.0 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.133 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.448 ' HG2' ' HB3' ' A' ' 70' ' ' LYS . 12.0 pt20 -83.86 92.98 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.319 0.58 . . . . 0.0 110.588 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.626 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 89.9 m95 -65.47 104.99 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.063 177.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -123.18 133.62 54.22 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.529 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 97.0 m95 -73.44 151.47 41.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.401 HG13 ' CD2' ' A' ' 37' ' ' HIS . 9.9 p -70.42 -5.84 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -172.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.3 p-10 -106.81 10.37 30.76 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 122.224 -0.297 . . . . 0.0 110.207 177.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 78' ' ' GLN . 5.2 tt0 81.04 6.36 1.33 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 124.275 0.984 . . . . 0.0 111.436 178.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.529 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 41.3 m -61.46 121.83 66.45 Favored Pre-proline 0 C--O 1.237 0.42 0 CA-C-O 121.008 0.432 . . . . 0.0 110.28 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -63.48 145.4 92.11 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 123.082 2.521 . . . . 0.0 112.544 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.626 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 71.9 t80 -61.52 134.26 56.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.108 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.545 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -95.23 106.71 27.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.275 175.296 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 27.3 Cg_exo -62.96 -24.86 74.04 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.631 2.22 . . . . 0.0 112.486 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -99.21 3.68 46.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.325 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.545 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 76.2 mtt180 -134.82 30.26 3.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.853 0.359 . . . . 0.0 111.32 -177.201 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.481 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 4.9 p -87.86 98.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.759 0.79 . . . . 0.0 109.552 174.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.38 74.14 10.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.481 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -64.23 156.35 29.04 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 173.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.639 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 24.7 t-80 . . . . . 0 C--N 1.324 -0.524 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.606 -173.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.771 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.4 p-10 . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.79 0.328 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 81.5 m -142.32 127.74 18.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.752 -173.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.657 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 16.8 m -78.9 146.67 7.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.014 0.435 . . . . 0.0 111.239 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 m -125.51 148.44 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.565 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.81 ' HG ' HD11 ' A' ' 62' ' ' LEU . 5.9 mt -83.88 106.13 15.32 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.4 p -128.54 139.61 51.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.847 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -83.42 97.35 8.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.771 174.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -137.75 139.46 40.11 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.688 -174.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 58.23 49.84 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.4 p30 53.05 18.91 1.23 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.551 1.14 . . . . 0.0 113.394 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HB3' ' NZ ' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -145.69 144.93 30.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.477 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.401 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.0 m95 -79.22 127.74 32.43 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.74 172.105 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -167.94 173.86 7.86 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.269 0.356 . . . . 0.0 110.259 174.026 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.657 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.4 m0 -84.17 119.02 24.52 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.998 0.428 . . . . 0.0 111.135 -176.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -105.76 132.39 51.94 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 166.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.771 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 8.4 t70 -85.99 123.79 31.71 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.746 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 42.1 t -132.31 140.61 38.5 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -43.19 127.91 5.48 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.92 2.413 . . . . 0.0 111.668 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 5.8 m -69.65 -6.94 34.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.529 -172.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -96.61 9.64 40.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.433 ' O ' ' HA ' ' A' ' 23' ' ' THR . 80.9 t80 -86.31 132.21 34.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.038 176.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.491 ' OE2' HG23 ' A' ' 23' ' ' THR . 8.6 mm-40 -80.11 116.6 20.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.284 175.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.453 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -142.79 -168.97 2.9 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.531 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.431 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 27.0 m -82.66 171.43 14.03 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.031 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -148.79 161.82 41.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.575 HG21 ' SD ' ' A' ' 39' ' ' MET . 4.4 mm -123.75 133.27 69.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.172 172.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 94.7 m -118.82 134.24 55.29 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.362 0.601 . . . . 0.0 110.328 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -112.18 135.95 52.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 -172.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.5 tt -139.06 142.45 33.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -64.52 166.96 16.09 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.306 2.004 . . . . 0.0 111.605 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.473 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -61.83 89.9 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.52 173.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.1 p -72.18 9.22 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 t -70.46 -15.32 62.8 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.82 -20.04 39.88 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.036 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -88.95 -46.99 8.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.228 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.8 26.11 2.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.886 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.19 -48.93 79.25 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -174.713 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 19.2 t-20 -73.93 -30.28 62.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 0.0 110.397 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.88 -45.11 90.87 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -74.63 -21.54 59.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.734 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -70.85 -34.67 71.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.056 0.455 . . . . 0.0 110.241 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -86.7 -6.25 58.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.747 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.211 -175.842 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.234 0.289 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.456 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 83.3 Cg_exo -48.37 143.98 14.24 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.063 2.509 . . . . 0.0 112.728 -177.634 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 27.9 pt -71.69 -11.56 15.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.34 -172.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.66 -18.95 39.24 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.598 ' HH2' ' HG3' ' A' ' 34' ' ' MET . 16.2 m0 -66.32 162.81 19.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.526 177.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.7 tpp180 -90.3 110.87 21.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.992 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.717 ' HB1' HD21 ' A' ' 133' ' ' LEU . . . -93.26 121.42 34.61 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.567 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 88.0 t80 -136.45 133.97 37.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.955 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.442 ' HG3' ' CE2' ' A' ' 10' ' ' PHE . 48.1 mt-30 57.48 -94.77 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.688 0.618 . . . . 0.0 110.77 -174.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.0 p -141.03 27.72 1.95 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -131.57 160.41 35.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.715 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.61 ' HB2' HG23 ' A' ' 128' ' ' ILE . 7.8 m -117.59 127.36 53.89 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.567 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 22.4 m-85 -117.3 145.83 43.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.55 -174.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.503 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 5.8 t80 -136.41 115.2 10.68 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.305 176.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 4.8 Cg_endo -88.19 117.39 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.385 2.723 . . . . 0.0 111.828 177.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.589 ' HG ' ' NH2' ' A' ' 124' ' ' ARG . 3.5 mm? -95.23 142.13 28.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.422 -178.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 p -110.58 4.51 20.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -81.67 168.51 18.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.354 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.441 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 3.1 p-10 -104.37 129.54 52.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.751 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.586 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 14.4 mmmm -156.17 141.32 17.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.633 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 34.6 p -57.35 160.98 3.61 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 173.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.537 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 52.9 t90 -56.6 -44.13 80.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -55.23 -47.38 75.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.408 177.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.586 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 38.5 mm-40 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.698 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 124' ' ' ARG . 49.5 m -59.25 -48.0 83.26 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.715 0.293 . . . . 0.0 110.66 173.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 36.0 tt0 -56.83 -44.16 81.79 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.797 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 78.0 mtt180 -75.54 -35.11 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.595 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -72.14 -28.72 63.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.442 -170.885 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 32' ' ' SER . 18.6 m -97.97 127.03 43.66 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 166.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 58.3 p 166.13 -60.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.303 0.377 . . . . 0.0 110.448 -174.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.08 -25.38 59.69 Favored Glycine 0 C--N 1.331 0.283 0 CA-C-N 115.384 -0.826 . . . . 0.0 113.36 -176.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.598 ' HG3' ' HH2' ' A' ' 7' ' ' TRP . 0.9 OUTLIER -86.56 15.46 5.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.8 0.333 . . . . 0.0 110.591 178.409 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.22 23.3 63.57 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.613 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -124.62 -179.09 4.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.361 0.6 . . . . 0.0 111.822 -172.495 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -137.16 169.12 18.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.521 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 30.4 tp -60.96 128.38 36.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 168.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.658 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 24.6 ttt -47.35 112.26 0.51 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -167.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 p -93.0 110.54 22.01 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.242 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.564 HD13 ' CE ' ' A' ' 39' ' ' MET . 16.5 mm -55.12 106.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 109.523 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -88.47 -38.37 15.06 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.627 -174.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 16.3 p -137.8 154.68 49.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.061 0.458 . . . . 0.0 110.866 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.93 -32.93 74.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.849 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -74.01 -34.69 64.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.729 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB3' ' O ' ' A' ' 43' ' ' THR . 37.0 tt0 -54.98 -50.16 69.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.109 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.535 ' O ' HG23 ' A' ' 51' ' ' ILE . 5.3 tt0 -63.02 -47.32 83.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.736 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.849 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.8 p30 -68.43 -28.13 66.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.772 0.32 . . . . 0.0 111.356 -174.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -88.54 -17.78 29.52 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 47' ' ' GLN . 10.2 tp -87.45 -28.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 118.679 0.672 . . . . 0.0 111.09 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.696 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.7 pt -69.9 -11.16 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -87.29 -18.32 30.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.734 0.302 . . . . 0.0 110.672 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -91.65 -22.09 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 109.658 177.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 90.8 mt -74.91 145.33 42.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.458 178.211 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 12.2 t70 -74.72 117.4 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.499 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 43.2 mtt180 -68.98 57.95 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.471 0.482 . . . . 0.0 111.759 -178.299 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 2.9 ttp180 -158.2 -33.5 0.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 55' ' ' ASP . 2.9 mm? -92.53 167.64 11.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.386 0.612 . . . . 0.0 111.672 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.791 ' HB3' HG21 ' A' ' 103' ' ' VAL . 1.4 m -112.88 118.87 36.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.847 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.403 ' C ' HG23 ' A' ' 103' ' ' VAL . 92.4 m-85 -107.84 121.03 43.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.235 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.536 ' CE2' ' HB3' ' A' ' 122' ' ' ALA . 26.7 m-85 -71.97 144.96 48.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.693 0.283 . . . . 0.0 111.149 177.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.651 HD13 HD23 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -133.2 176.59 8.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 174.787 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.509 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -79.74 62.51 4.14 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 115.067 0.787 . . . . 0.0 115.067 -167.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.651 HD23 HD13 ' A' ' 62' ' ' LEU . 3.5 mm? -115.12 104.61 12.03 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 166.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.523 ' HB2' HG12 ' A' ' 76' ' ' VAL . 3.3 ttm-85 -93.82 116.91 29.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.197 0.522 . . . . 0.0 111.925 -169.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.701 ' HB3' ' HB2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -134.13 85.77 2.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.381 175.505 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -87.72 31.28 0.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.978 0.894 . . . . 0.0 108.817 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.677 ' HB3' ' HZ2' ' A' ' 70' ' ' LYS . 65.2 t30 179.05 137.17 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -168.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.51 87.51 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 120.946 0.403 . . . . 0.0 110.152 170.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HZ2' ' HB3' ' A' ' 68' ' ' ASN . 2.2 ptpp? -126.33 118.91 26.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.821 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.01 54.03 2.19 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.969 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.592 ' HG2' ' HB2' ' A' ' 70' ' ' LYS . 9.8 pt20 -154.26 44.68 0.55 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.684 ' CH2' ' HB3' ' A' ' 100' ' ' ASN . 77.4 m95 -37.11 117.0 0.49 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.5 1.125 . . . . 0.0 112.449 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -117.39 156.89 27.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.068 0.461 . . . . 0.0 111.097 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.509 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 42.1 m95 -86.84 153.37 21.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.674 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 ' HB2' ' A' ' 65' ' ' ARG . 34.7 m -73.33 -6.94 8.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -173.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -129.54 81.75 2.04 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.369 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 68.29 -56.45 0.5 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.273 1.029 . . . . 0.0 113.117 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.492 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 18.2 m -44.23 120.16 3.64 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 79' ' ' THR . 33.1 Cg_endo -66.91 169.64 14.42 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.361 2.708 . . . . 0.0 111.957 170.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -54.25 137.62 40.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.721 -177.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -91.09 108.23 26.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.08 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.84 -24.02 25.21 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 113.071 -176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -95.4 -27.39 15.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.778 0.323 . . . . 0.0 111.361 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -112.4 83.72 1.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.167 0.508 . . . . 0.0 111.487 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 t -124.22 100.92 8.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.14 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -98.28 92.34 5.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.677 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -96.09 173.79 7.24 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.517 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 79.8 m-70 . . . . . 0 C--N 1.327 -0.387 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.081 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.701 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 5.1 m-20 . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.709 ' HB2' ' O ' ' A' ' 116' ' ' VAL . 2.3 m 66.8 116.46 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 O-C-N 124.01 0.819 . . . . 0.0 111.6 168.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.63 HG13 ' CH2' ' A' ' 73' ' ' TRP . 4.7 m -107.16 144.98 15.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.645 0.736 . . . . 0.0 112.694 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.791 HG21 ' HB3' ' A' ' 59' ' ' SER . 2.2 p -111.43 148.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.394 175.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HG ' ' CD2' ' A' ' 62' ' ' LEU . 12.0 mt -82.29 101.65 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 164.182 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.21 150.21 25.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 -175.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -81.35 115.16 20.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.061 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 40.2 t30 -162.1 129.85 3.99 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.429 ' C ' ' H ' ' A' ' 110' ' ' LYS . 64.8 mt-30 69.09 35.9 2.61 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -173.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.5 t70 71.31 -25.46 0.17 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.802 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' A' ' 108' ' ' GLN . 21.3 pttm -101.2 146.75 27.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.504 0.669 . . . . 0.0 111.15 -173.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.696 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 69.3 m95 -81.91 130.86 35.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.423 172.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -156.17 167.17 31.26 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.567 ' HA ' ' O ' ' A' ' 103' ' ' VAL . 42.0 m0 -71.74 143.59 49.56 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.667 0.605 . . . . 0.0 110.78 -176.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 3.9 t30 -140.52 147.47 39.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.39 174.634 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.92 124.64 23.56 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.387 0.429 . . . . 0.0 111.039 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.709 ' O ' ' HB2' ' A' ' 101' ' ' CYS . 3.5 m -154.89 116.46 2.42 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.694 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.17 147.59 8.1 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.8 2.333 . . . . 0.0 112.777 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.596 ' O ' ' HB ' ' A' ' 23' ' ' THR . 33.5 m -70.22 -11.52 60.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.65 0.262 . . . . 0.0 111.023 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -89.97 6.61 41.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.633 ' O ' ' HA ' ' A' ' 23' ' ' THR . 79.0 t80 -93.99 133.26 37.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.487 ' OE2' HG23 ' A' ' 23' ' ' THR . 7.8 mm-40 -83.67 134.24 34.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.047 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.536 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -159.47 -170.2 2.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.351 174.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 30.0 m -81.0 164.82 22.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.793 -177.43 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.589 ' NH2' ' HG ' ' A' ' 18' ' ' LEU . 42.1 mtm105 -127.86 161.72 28.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.137 0.494 . . . . 0.0 111.913 -170.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 19.5 mt -134.3 125.25 47.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 57.7 m -102.66 129.69 49.33 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.658 ' HB3' ' HA ' ' A' ' 39' ' ' MET . 1.1 tppp? -114.85 122.55 46.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.007 0.432 . . . . 0.0 110.838 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 14' ' ' CYS . 8.3 tt -129.34 140.94 40.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.024 174.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.462 ' HD2' HG13 ' A' ' 128' ' ' ILE . 19.7 Cg_endo -59.16 153.26 53.79 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.265 1.976 . . . . 0.0 111.914 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -74.35 57.81 2.41 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.073 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.9 t -60.3 -35.32 75.31 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 122.736 0.415 . . . . 0.0 111.132 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.4 p -94.85 2.16 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.957 0.408 . . . . 0.0 111.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.717 HD21 ' HB1' ' A' ' 9' ' ' ALA . 10.5 mp -90.16 -31.38 17.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -87.29 -55.63 3.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.178 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 139' ' ' TYR . . . -90.14 40.06 0.99 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.436 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -50.2 72.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -175.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -80.1 -31.15 39.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.226 0.536 . . . . 0.0 110.285 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.41 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 2.3 tm? -61.24 -44.41 97.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.281 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 135' ' ' ALA . 0.2 OUTLIER -76.09 -25.09 55.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.989 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -67.47 -31.2 71.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -86.92 -5.43 59.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.123 -177.263 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' SG ' ' HA2' ' A' ' 130' ' ' GLY . 13.3 m . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 121.01 0.433 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 4.6 Cg_endo -86.51 163.02 9.53 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.554 2.836 . . . . 0.0 113.881 -176.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.1 mt 56.88 -98.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.572 171.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -118.93 15.46 13.38 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.537 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 79.0 m95 -68.63 105.09 2.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 30.3 mmt180 -73.35 114.46 11.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.896 -173.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.76 121.73 28.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.766 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.465 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 87.5 t80 -129.93 102.67 6.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.878 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 66.76 -70.7 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.568 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -142.35 -11.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.119 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -100.33 159.06 15.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.9 0.381 . . . . 0.0 111.487 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 73.4 m -133.69 127.95 33.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.668 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.466 ' OH ' ' HG3' ' A' ' 46' ' ' GLU . 13.2 m-85 -121.37 137.75 54.56 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.738 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 33.4 t80 -124.26 114.93 27.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.711 0.291 . . . . 0.0 110.357 176.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 19.2 Cg_endo -89.53 128.13 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 123.346 2.698 . . . . 0.0 112.429 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.572 HD22 ' NH2' ' A' ' 124' ' ' ARG . 4.1 mp -119.36 139.18 52.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.5 p -107.76 19.97 19.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -93.17 138.31 31.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.92 0.39 . . . . 0.0 110.867 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -56.38 115.56 2.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.719 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.491 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -156.11 141.1 17.27 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.904 0.383 . . . . 0.0 110.896 -174.142 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' HG3' ' A' ' 26' ' ' GLU . 77.7 p -81.65 158.46 24.29 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 54.6 t90 -57.17 -45.05 84.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.917 0.389 . . . . 0.0 110.634 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.17 91.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.177 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.545 ' HG2' ' NH1' ' A' ' 29' ' ' ARG . 47.3 mt-10 -72.46 -35.41 68.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.221 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.591 ' HB3' ' HD3' ' A' ' 124' ' ' ARG . 67.3 m -52.3 -51.28 59.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.03 175.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.428 ' CD ' ' HD1' ' A' ' 37' ' ' HIS . 9.8 tp10 -76.69 -21.08 55.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.605 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.545 ' NH1' ' HG2' ' A' ' 26' ' ' GLU . 53.1 ttp180 -68.4 -37.41 80.33 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.079 0.466 . . . . 0.0 110.762 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -81.15 -37.27 29.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.519 0.676 . . . . 0.0 110.035 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 32' ' ' SER . 86.6 m -85.47 179.91 7.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.631 175.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.688 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 27.6 t 79.62 -43.65 0.29 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 122.715 0.406 . . . . 0.0 110.643 -177.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.94 -20.07 64.11 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.325 175.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.3 mtm -92.15 9.22 34.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 0.0 110.343 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.13 51.03 7.11 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -172.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.688 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -144.56 -178.35 5.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.936 0.398 . . . . 0.0 111.446 -170.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.428 ' HD1' ' CD ' ' A' ' 28' ' ' GLU . 2.9 m-70 -159.46 166.84 30.1 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 169.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.92 158.4 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.589 174.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.408 ' SD ' ' HD1' ' A' ' 15' ' ' TYR . 65.3 mmm -46.51 104.19 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -174.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.474 ' HA ' ' CZ3' ' A' ' 75' ' ' TRP . 18.9 p -98.72 93.28 6.0 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.498 0.665 . . . . 0.0 109.388 169.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.5 mt -76.01 122.47 30.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.158 -173.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.0 m -107.86 -27.29 10.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.874 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.1 p -134.53 155.74 49.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.619 0.723 . . . . 0.0 112.241 -176.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -65.67 -37.96 87.96 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.623 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.702 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -69.33 -37.85 77.91 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.466 ' HG3' ' OH ' ' A' ' 15' ' ' TYR . 67.1 tt0 -53.72 -50.62 65.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.584 0.707 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.432 ' O ' HG23 ' A' ' 51' ' ' ILE . 0.0 OUTLIER -64.14 -48.67 75.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.008 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.702 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.0 OUTLIER -68.12 -27.27 66.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.025 -175.529 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.611 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 3.2 m-85 -80.6 -32.48 36.41 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 178.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.56 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 8.9 tp -78.51 -30.47 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.527 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 40.9 pt -71.17 -9.69 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 20.6 pt20 -87.48 -13.44 43.14 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.382 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.63 -23.6 17.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.2 0.524 . . . . 0.0 109.639 174.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.9 mt -74.31 150.17 40.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.594 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' A' ' 57' ' ' ARG . 45.1 t0 -80.43 127.43 32.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.641 178.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.582 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 75.1 mtt180 -80.28 30.17 0.28 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -167.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.57 ' HG2' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -139.38 -1.2 1.72 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.779 169.411 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mp -100.74 157.7 16.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.13 0.49 . . . . 0.0 111.397 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.72 ' HB3' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -109.81 117.3 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.427 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 83.6 m-85 -108.77 121.46 45.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.522 0.201 . . . . 0.0 111.201 -176.484 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -64.99 141.82 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.186 0.517 . . . . 0.0 112.103 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.648 HD11 ' HG ' ' A' ' 104' ' ' LEU . 65.0 mt -107.06 158.73 16.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.152 175.135 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.58 49.98 4.15 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.217 -174.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.618 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 40.2 tp -131.59 124.07 29.24 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.8 ptm85 -133.99 154.37 51.16 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.748 0.785 . . . . 0.0 112.493 -174.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -112.17 152.52 28.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.216 -1.356 . . . . 0.0 107.359 166.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.591 ' HB3' ' HD2' ' A' ' 70' ' ' LYS . 4.2 tp10 -109.41 104.56 13.67 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.881 -172.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 93.5 m-20 72.26 -66.74 0.29 Allowed 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.745 0.653 . . . . 0.0 110.798 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -179.82 80.26 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 123.75 0.82 . . . . 0.0 108.828 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.612 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 17.1 mtpp -101.51 -61.6 1.36 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.329 -174.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 115.53 -21.84 12.44 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.612 ' OE1' ' HB3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -113.96 107.23 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.687 0.756 . . . . 0.0 110.309 177.027 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.618 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 25.7 m95 -76.15 150.9 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.951 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 143.52 46.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 176.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.474 ' CZ3' ' HA ' ' A' ' 40' ' ' THR . 98.7 m95 -74.98 161.72 29.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.7 p -75.96 -6.57 8.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.384 0.611 . . . . 0.0 111.396 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 15.4 p30 -109.0 21.24 17.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.284 175.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 57.8 tp60 79.29 -8.18 1.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.146 174.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 36.1 m -58.84 124.34 72.87 Favored Pre-proline 0 C--N 1.323 -0.569 0 O-C-N 122.06 -0.4 . . . . 0.0 110.525 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 32.2 Cg_exo -62.54 149.57 90.58 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.534 2.156 . . . . 0.0 111.763 175.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.447 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 76.2 t80 -59.92 122.63 14.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.0 111.756 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.474 ' ND2' ' HB3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -82.19 106.76 7.0 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.49 174.349 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -63.7 -53.27 1.39 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.085 2.523 . . . . 0.0 112.484 -176.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -89.83 34.41 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.975 0.416 . . . . 0.0 111.305 -177.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 82' ' ' ASN . 12.2 tpt180 -140.43 21.73 2.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.215 0.531 . . . . 0.0 109.623 176.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.537 HG23 ' CE3' ' A' ' 113' ' ' TRP . 11.0 p -107.04 148.8 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.11 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -129.0 74.74 1.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.25 -0.18 . . . . 0.0 110.692 -177.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.69 174.25 5.29 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.023 0.439 . . . . 0.0 111.102 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.643 ' CE1' ' HB2' ' A' ' 107' ' ' ASN . 54.5 m-70 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.688 0.28 . . . . 0.0 110.854 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.451 -0.387 0 CA-C-O 120.643 0.259 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 56.2 m -136.15 143.27 44.4 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.941 0.401 . . . . 0.0 109.981 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 62' ' ' LEU . 12.1 p -95.04 145.06 8.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.256 0.55 . . . . 0.0 111.841 -171.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 59' ' ' SER . 1.0 OUTLIER -126.95 142.5 43.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.353 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.648 ' HG ' HD11 ' A' ' 62' ' ' LEU . 11.3 mt -83.64 109.44 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 167.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.43 148.28 31.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.609 -176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.582 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 10.2 t80 -87.75 96.09 10.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.095 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.643 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 91.8 m-20 -131.48 144.04 50.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 65.89 24.73 11.23 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.62 0.575 . . . . 0.0 109.634 -176.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.64 22.94 12.73 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.833 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -137.08 148.3 46.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.025 0.44 . . . . 0.0 110.65 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.527 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 81.5 m95 -79.66 124.38 28.5 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.493 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -158.27 167.19 30.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.898 0.38 . . . . 0.0 111.096 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.537 ' CE3' HG23 ' A' ' 86' ' ' VAL . 7.6 m0 -78.55 138.75 38.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.969 -176.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -134.64 144.82 48.08 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -86.27 124.86 33.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.866 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.6 m -141.26 158.78 63.32 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.41 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 14.2 Cg_endo -58.1 133.17 53.72 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.406 2.071 . . . . 0.0 111.011 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 24' ' ' TRP . 3.8 t -72.52 -16.99 61.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.992 0.425 . . . . 0.0 111.245 -173.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -89.95 4.6 49.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.009 0.433 . . . . 0.0 110.185 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.516 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 63.3 t80 -81.2 151.01 28.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -102.93 142.34 34.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.23 0.538 . . . . 0.0 110.995 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.91 -167.62 1.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.26 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 26.4 m -78.91 170.99 15.82 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.141 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.591 ' HD3' ' HB3' ' A' ' 27' ' ' SER . 4.2 ttp180 -144.84 145.57 31.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -168.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.668 HG13 ' HB3' ' A' ' 60' ' ' TYR . 9.6 mt -128.4 125.29 63.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 89.8 m -113.04 146.58 38.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.037 0.446 . . . . 0.0 110.512 177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -121.12 132.92 55.15 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.304 -170.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 36' ' ' ALA . 29.3 mt -128.59 141.06 40.27 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.979 176.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.582 ' HB2' HG23 ' A' ' 131' ' ' THR . 13.4 Cg_exo -65.87 133.59 34.29 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.325 1.35 . . . . 0.0 110.251 169.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.483 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -48.24 -55.93 9.84 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 121.224 -0.512 . . . . 0.0 112.105 -177.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' THR . . . . . 0.582 HG23 ' HB2' ' A' ' 129' ' ' PRO . 48.0 p 61.93 -31.76 0.08 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.078 1.351 . . . . 0.0 113.849 176.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 130' ' ' GLY . 10.3 t -63.12 -21.83 66.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.462 0.305 . . . . 0.0 111.045 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 133' ' ' LEU . 2.8 mm? -56.37 -21.23 23.44 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.627 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -87.39 -41.68 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.101 0.477 . . . . 0.0 110.195 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.79 16.95 8.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.271 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -55.49 -52.43 63.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.002 0.429 . . . . 0.0 111.246 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -73.77 -27.66 61.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.476 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -63.2 -47.99 80.22 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.645 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 53.2 t80 -75.12 -24.31 58.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.332 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -65.79 -26.56 67.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.347 0.594 . . . . 0.0 109.979 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.71 -32.79 25.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.423 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' SER . . . . . 0.645 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 96.7 p . . . . . 0 C--O 1.252 1.23 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.577 -170.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 76.2 m . . . . . 0 N--CA 1.455 -0.219 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.557 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 66.2 Cg_exo -53.07 154.15 14.24 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.356 2.037 . . . . 0.0 112.417 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.6 tp -70.47 -17.39 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.092 -171.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -83.16 -23.85 32.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.863 0.363 . . . . 0.0 110.841 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.557 ' HD1' ' HB2' ' A' ' 4' ' ' PRO . 37.2 m95 -82.1 154.86 25.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.027 0.442 . . . . 0.0 110.258 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 34.9 mmt-85 -108.61 118.13 35.97 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.119 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.46 133.05 35.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.974 -174.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.482 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.1 t80 -129.15 102.24 6.38 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 58.31 -97.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.777 -176.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.9 p -93.63 -38.43 11.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.92 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -82.56 168.45 17.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.537 -172.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 72.0 m -146.71 129.46 16.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.579 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.511 ' CE2' ' HE3' ' A' ' 127' ' ' LYS . 5.0 m-85 -120.93 141.91 50.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.578 0.228 . . . . 0.0 110.994 -173.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.42 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 47.4 t80 -128.69 118.23 19.85 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.018 176.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -84.69 120.16 2.34 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.672 2.248 . . . . 0.0 112.07 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.635 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.1 mp -109.08 139.83 43.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.996 0.427 . . . . 0.0 110.188 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.9 p -106.3 13.37 28.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.479 -177.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 12.4 p-10 -79.35 126.24 30.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.57 ' HB2' ' HB3' ' A' ' 121' ' ' GLU . 5.4 p-10 -70.59 104.45 2.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.73 0.776 . . . . 0.0 110.692 -177.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 22' ' ' LYS . 64.3 mmtt -135.71 156.71 48.4 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.217 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.0 p -77.67 171.55 14.77 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.371 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -60.07 -40.25 88.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.194 0.521 . . . . 0.0 109.996 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.7 -48.77 75.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.244 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.667 ' HG2' HH11 ' A' ' 29' ' ' ARG . 19.7 mt-10 -68.2 -34.97 77.25 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.283 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.443 ' HB3' HD11 ' A' ' 38' ' ' LEU . 67.9 m -53.17 -50.46 64.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.008 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HG2' HD13 ' A' ' 38' ' ' LEU . 9.5 mm-40 -72.1 -22.23 61.38 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.724 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.667 HH11 ' HG2' ' A' ' 26' ' ' GLU . 51.1 mtp180 -69.03 -35.53 76.74 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.767 0.318 . . . . 0.0 111.273 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -80.51 -28.52 37.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.556 0.693 . . . . 0.0 109.747 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 93.4 m -85.42 178.61 7.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.473 173.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 t 74.96 -50.65 0.67 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.819 0.447 . . . . 0.0 110.954 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.15 -25.12 69.37 Favored Glycine 0 C--O 1.227 -0.293 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.151 178.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.3 mtm -91.89 6.08 47.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.579 0.228 . . . . 0.0 110.619 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.33 -1.18 87.98 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.64 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.82 -176.75 3.67 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.708 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.17 163.1 40.01 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 176.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 28' ' ' GLU . 5.2 mp -56.16 144.66 28.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.04 0.448 . . . . 0.0 111.528 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.441 ' HA ' ' HD2' ' A' ' 127' ' ' LYS . 14.2 tpt -53.43 113.37 1.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.656 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.429 ' H ' ' CD ' ' A' ' 127' ' ' LYS . 38.6 p -104.62 135.95 45.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.059 171.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.8 mt -105.61 116.79 50.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.159 0.504 . . . . 0.0 110.716 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -97.63 -40.58 8.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.233 -178.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.6 p -135.02 167.23 21.32 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.2 0.524 . . . . 0.0 111.378 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -70.66 -34.71 72.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.845 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -64.08 -46.62 83.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.384 178.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -54.98 -47.77 74.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.092 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 51' ' ' ILE . 35.0 tt0 -59.79 -56.37 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.044 176.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 12.6 m-80 -53.82 -42.19 68.15 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.197 -176.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.436 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 22.6 m-85 -67.19 -44.9 78.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.2 tp -75.52 -32.14 24.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.828 -174.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.577 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.1 pt -70.45 -7.09 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 110.981 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 98.6 mt-30 -87.13 -23.13 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.678 174.28 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -89.28 -21.49 23.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.093 0.473 . . . . 0.0 110.156 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 71.2 mt -78.05 145.03 36.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.126 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.424 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.8 t70 -77.65 127.85 33.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.036 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.563 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.1 mtt180 -75.86 24.67 0.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -171.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.811 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.9 ptp180 -124.38 -15.75 6.58 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.075 175.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.811 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.4 mm? -95.7 161.99 13.8 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.278 0.561 . . . . 0.0 111.624 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.5 m -118.29 117.08 28.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.225 175.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.728 ' HB3' HG13 ' A' ' 125' ' ' ILE . 87.0 m-85 -102.09 124.86 48.43 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -169.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.493 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -58.85 135.73 57.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.843 0.354 . . . . 0.0 111.812 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.454 HD11 HD13 ' A' ' 104' ' ' LEU . 68.0 mt -115.85 175.0 5.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.272 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.61 -15.91 80.96 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.918 -0.658 . . . . 0.0 114.176 -174.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.574 HD11 ' HB3' ' A' ' 73' ' ' TRP . 47.6 tp -71.08 120.26 16.4 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.956 0.878 . . . . 0.0 110.88 -172.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -116.79 137.82 51.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.956 -174.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.542 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 6.6 t70 -113.21 139.02 49.13 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 158.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 26.0 tt0 -114.34 92.38 3.94 Favored 'General case' 0 C--N 1.31 -1.118 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.435 -173.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 76.09 -63.79 0.38 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 124.311 1.007 . . . . 0.0 110.001 -176.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 179.3 77.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.424 1.078 . . . . 0.0 108.69 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 51.8 mttp -121.76 125.94 47.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.767 -176.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.54 54.55 3.68 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.301 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -154.4 66.14 0.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.363 0.602 . . . . 0.0 110.182 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.574 ' HB3' HD11 ' A' ' 64' ' ' LEU . 91.1 m95 -57.78 128.77 38.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.707 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.723 ' HD3' ' HA ' ' A' ' 78' ' ' GLN . 13.3 ttm180 -137.93 149.63 46.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.338 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.637 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 95.6 m95 -80.33 109.24 14.62 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 171.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.566 HG13 ' H ' ' A' ' 77' ' ' ASP . 2.8 p 28.25 -72.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 175.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.566 ' H ' HG13 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -78.85 -86.75 0.07 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 0.0 111.56 -173.41 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.723 ' HA ' ' HD3' ' A' ' 74' ' ' ARG . 21.6 tp60 -145.99 -1.72 0.75 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.1 0.476 . . . . 0.0 109.87 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.637 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 71.4 m -60.46 117.48 24.95 Favored Pre-proline 0 N--CA 1.452 -0.367 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.384 178.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 28.5 Cg_exo -63.85 147.11 92.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.177 2.585 . . . . 0.0 112.978 -176.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.39 147.01 52.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.472 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -83.6 124.7 75.07 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.304 -177.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.71 -2.66 12.9 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.651 2.234 . . . . 0.0 113.86 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HA ' ' HE ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -130.39 -34.53 1.6 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.79 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -83.47 82.53 8.25 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.969 0.414 . . . . 0.0 110.016 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.87 111.0 28.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.762 -178.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -121.09 91.88 3.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.022 -175.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -99.68 -178.44 3.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 110.98 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.597 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 28.6 m80 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.574 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 35.1 t30 . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 121.245 0.545 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 59.2 m -120.85 132.92 55.27 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.594 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 15.5 m -88.8 141.85 13.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.291 0.567 . . . . 0.0 111.035 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 61' ' ' PHE . 27.8 m -115.67 152.65 17.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.82 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.454 HD13 HD11 ' A' ' 62' ' ' LEU . 16.7 tp -83.55 101.85 11.74 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 174.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p -118.68 142.51 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.283 0.563 . . . . 0.0 111.283 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.418 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 88.2 t80 -77.86 117.89 19.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.47 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.473 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 22.7 t-20 -151.48 116.38 5.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.467 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 66.03 46.65 2.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.402 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 74.31 -25.45 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.371 1.044 . . . . 0.0 112.231 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -106.22 146.04 30.8 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.457 0.646 . . . . 0.0 111.45 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.577 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 61.5 m95 -91.73 136.36 33.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.193 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.597 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -156.04 171.33 20.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.594 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 6.9 m0 -77.84 138.7 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.302 0.377 . . . . 0.0 110.451 -175.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -130.37 129.88 43.67 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.47 124.4 23.47 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.572 0.545 . . . . 0.0 111.417 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.4 m -146.41 157.72 48.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.86 138.46 85.85 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.026 1.817 . . . . 0.0 111.467 174.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.5 m -62.76 -20.1 64.63 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.14 0.495 . . . . 0.0 110.356 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -98.12 80.65 2.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.729 0.776 . . . . 0.0 109.11 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -155.26 110.09 2.98 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.434 -1.257 . . . . 0.0 108.232 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 21' ' ' ASN . 5.6 mp0 -63.28 110.27 1.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.102 0.477 . . . . 0.0 111.224 -175.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -140.35 -174.03 3.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.553 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.6 p -83.15 171.61 13.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.635 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -147.92 147.98 30.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.909 0.385 . . . . 0.0 111.906 -170.623 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.728 HG13 ' HB3' ' A' ' 60' ' ' TYR . 43.7 mt -117.43 131.76 69.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.3 t -117.54 133.8 55.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' A' ' 15' ' ' TYR . 21.3 ptmt -123.2 139.91 53.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.973 0.416 . . . . 0.0 110.39 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.614 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.9 tt -131.42 140.44 38.45 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 163.76 36.81 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.668 1.578 . . . . 0.0 110.749 170.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.04 59.66 1.41 Allowed Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.967 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.2 t -96.52 14.76 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 23.3 m -57.7 -32.4 67.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.728 ' H ' HD12 ' A' ' 133' ' ' LEU . 2.9 mp -71.18 -43.36 67.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.162 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -67.2 -26.31 66.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.468 0.652 . . . . 0.0 110.244 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.28 25.22 1.96 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.317 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 9.2 pt-20 -54.5 -51.43 65.12 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.712 0.291 . . . . 0.0 111.401 -178.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 25.3 t-20 -74.13 -32.25 63.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.37 -46.77 88.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -69.42 -29.31 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.509 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -67.46 -23.8 65.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.706 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 77.4 mt-30 -86.72 -5.57 59.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.642 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.909 -177.566 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.555 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 13.8 p . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.555 ' HD2' ' HB2' ' A' ' 3' ' ' CYS . 79.4 Cg_exo -48.89 139.88 24.5 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.542 2.161 . . . . 0.0 112.313 176.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tt -72.37 89.19 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 121.946 0.879 . . . . 0.0 110.741 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -172.81 -52.48 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.283 -1.326 . . . . 0.0 108.101 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -75.19 128.42 35.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.098 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -74.33 104.22 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.15 0.5 . . . . 0.0 110.686 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . . . -70.55 134.44 47.67 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.959 177.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 74.9 t80 -144.49 124.7 13.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.573 178.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 64.0 -82.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.353 0.661 . . . . 0.0 111.392 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.0 m -146.19 6.99 1.02 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -120.77 166.67 13.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 69.9 m -122.61 126.93 48.69 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.42 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 32.6 m-85 -120.15 117.05 26.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.456 -174.28 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.487 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 67.5 t80 -111.66 115.64 51.15 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 0.0 110.703 178.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -85.79 122.41 2.29 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.294 2.662 . . . . 0.0 112.203 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.91 138.4 41.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.752 0.31 . . . . 0.0 110.342 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.4 p -89.03 -4.28 58.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.32 0.581 . . . . 0.0 109.907 174.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.429 ' OD2' ' HD2' ' A' ' 22' ' ' LYS . 7.1 t70 -66.2 139.97 58.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.919 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -97.28 123.69 41.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.58 -174.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.429 ' HD2' ' OD2' ' A' ' 20' ' ' ASP . 5.9 mttp -155.54 158.81 39.06 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.958 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.628 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 72.6 p -70.74 167.16 19.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 174.368 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.727 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.6 t90 -61.07 -35.19 76.3 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.001 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -63.62 -52.23 61.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.71 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.1 -40.5 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.565 ' HB3' HD11 ' A' ' 38' ' ' LEU . 47.6 m -58.05 -40.38 80.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.288 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.437 ' HA ' HD21 ' A' ' 38' ' ' LEU . 43.9 tt0 -74.03 -26.22 60.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.12 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.4 mtm180 -79.03 -45.1 20.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.09 0.471 . . . . 0.0 110.961 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.1 -37.87 88.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.722 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.5 m -85.57 178.9 7.23 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 171.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 24.9 m 76.85 -47.19 0.52 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.903 0.481 . . . . 0.0 111.138 -178.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.53 -20.19 67.61 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.109 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.4 mtm -93.15 6.73 46.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.699 0.285 . . . . 0.0 110.573 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.1 -5.93 69.48 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.725 -175.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.42 179.43 5.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.458 -0.371 . . . . 0.0 110.701 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.727 ' HB3' HG13 ' A' ' 76' ' ' VAL . 97.3 m-70 -147.45 169.57 19.24 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 27' ' ' SER . 3.9 mm? -59.05 154.72 15.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.865 0.302 . . . . 0.0 111.283 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.949 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.7 tpt -49.77 108.47 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.458 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.595 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 70.3 p -108.15 108.04 18.93 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.283 0.563 . . . . 0.0 110.246 177.067 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.529 HD11 HD11 ' A' ' 104' ' ' LEU . 60.9 mt -73.42 103.09 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.453 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.4 m -77.99 -48.7 15.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.06 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 55.5 p -125.42 170.15 11.67 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.85 0.833 . . . . 0.0 111.871 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -61.82 -25.84 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.55 -41.68 72.15 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.285 177.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 43' ' ' THR . 1.9 mp0 -48.25 -54.88 12.06 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.209 0.528 . . . . 0.0 109.588 171.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -59.97 4.06 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.623 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -58.55 -40.51 83.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -173.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -84.44 -36.39 22.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.25 -33.36 57.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.824 -176.576 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 43.0 pt -69.99 -10.33 13.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -76.01 -33.99 59.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.926 0.394 . . . . 0.0 110.0 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.89 -25.65 24.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.552 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 80.6 mt -67.94 140.2 56.43 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.662 -178.434 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.534 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.3 t70 -77.4 128.84 34.95 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.571 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 82.5 mtt180 -81.04 7.42 10.88 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -167.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.928 ' HG2' HD22 ' A' ' 58' ' ' LEU . 5.0 ptp180 -103.8 -13.5 16.4 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.01 176.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.928 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -101.52 150.29 23.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.059 0.457 . . . . 0.0 110.912 179.043 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.1 m -107.15 124.52 49.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.624 ' HB3' HG13 ' A' ' 125' ' ' ILE . 88.6 m-85 -105.89 122.38 46.0 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -172.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.762 ' HA ' HG12 ' A' ' 103' ' ' VAL . 21.5 m-85 -59.92 140.63 56.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.633 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' HG ' ' A' ' 104' ' ' LEU . 82.4 mt -107.68 168.22 9.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.397 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -92.84 25.48 19.15 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.148 -177.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.654 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 38.7 tp -92.87 109.03 20.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HE ' ' HH2' ' A' ' 24' ' ' TRP . 13.2 ttm180 -96.34 122.07 38.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -173.048 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -104.59 154.26 20.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 157.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' ASN . 27.8 tt0 -135.24 95.82 3.37 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.284 -174.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 18.5 m120 78.7 -45.29 0.38 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.188 175.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' ASN . . . 165.14 -6.34 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.981 -171.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 35.1 mttp -68.09 94.03 0.47 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 172.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -69.0 72.56 0.39 Allowed Glycine 0 C--N 1.329 0.162 0 O-C-N 123.649 0.593 . . . . 0.0 113.266 -176.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -125.22 74.45 1.38 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 92.1 m95 -68.19 104.88 1.93 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.303 -175.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -134.15 152.34 51.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.164 177.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.595 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 85.5 m95 -85.88 147.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 120.256 -0.578 . . . . 0.0 109.599 177.499 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.727 HG13 ' HB3' ' A' ' 37' ' ' HIS . 11.3 p -77.53 -6.76 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -167.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -100.69 -60.05 1.59 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 121.334 -0.854 . . . . 0.0 111.214 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.403 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.0 OUTLIER -170.24 -21.57 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.172 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.3 m -60.33 122.07 64.48 Favored Pre-proline 0 C--O 1.24 0.592 0 CA-C-O 121.569 0.699 . . . . 0.0 111.811 -172.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.9 Cg_exo -71.12 157.31 57.91 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.223 2.615 . . . . 0.0 111.312 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -71.89 126.14 28.98 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.466 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.507 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 19.7 m-80 -96.24 106.38 28.42 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.417 179.046 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.03 -29.45 40.31 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.517 2.144 . . . . 0.0 112.211 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -78.98 -22.89 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.736 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 73.0 mtt180 -117.97 31.34 6.75 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.246 -171.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 86' ' ' VAL . 7.1 p -88.78 91.6 3.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 122.116 0.96 . . . . 0.0 109.661 175.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.01 68.12 9.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.366 -169.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.421 ' CD1' HG22 ' A' ' 86' ' ' VAL . 79.0 m95 -74.23 143.8 44.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 172.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 83.6 m-70 . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 171.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.8 t30 . . . . . 0 N--CA 1.471 0.596 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -154.83 160.7 41.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 173.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.461 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.3 m -107.65 148.02 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.17 0.509 . . . . 0.0 112.171 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.762 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -125.74 156.69 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.563 175.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.58 ' HG ' HD21 ' A' ' 62' ' ' LEU . 15.4 mt -86.53 118.39 25.92 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.3 p -134.81 143.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.601 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.4 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 34.5 t80 -80.56 105.72 12.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.754 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.424 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 48.1 t30 -156.81 140.03 15.57 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.155 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ASP . 41.9 mt-30 67.34 40.7 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.831 0.707 . . . . 0.0 109.688 -175.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 108' ' ' GLN . 31.2 t70 78.82 -16.22 0.69 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.493 174.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.75 170.79 15.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.477 0.656 . . . . 0.0 112.213 -174.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.571 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 72.2 m95 -88.07 130.63 34.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.539 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.587 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -153.04 171.1 18.91 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.409 ' HE1' HD12 ' A' ' 41' ' ' ILE . 26.7 m0 -78.01 131.88 37.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.554 0.534 . . . . 0.0 110.807 -173.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -121.17 127.95 52.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.087 174.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -82.8 125.69 31.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.254 0.549 . . . . 0.0 110.59 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.9 m -141.33 155.23 67.78 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.159 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.89 133.12 53.88 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.18 1.92 . . . . 0.0 111.246 172.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.727 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 66.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.181 -178.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -77.24 -7.77 56.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.427 . . . . 0.0 110.651 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -83.59 140.98 31.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -104.52 145.21 30.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.223 0.535 . . . . 0.0 111.33 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -159.8 -168.78 2.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.353 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.3 m -78.39 170.82 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.464 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 12.9 ptt180 -152.17 148.07 27.18 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.944 -171.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.3 mt -113.23 135.26 53.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.5 t -114.31 130.78 56.67 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -115.54 131.94 56.78 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.655 -175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.543 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.2 tt -127.54 138.5 32.96 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 175.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -64.48 166.32 17.79 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.048 1.832 . . . . 0.0 111.042 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.13 82.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.924 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 17.0 p -76.36 18.53 0.3 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 122.818 0.447 . . . . 0.0 111.797 -177.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -65.36 -14.41 60.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.106 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -69.69 -29.48 66.91 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.505 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.412 HD22 ' C ' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -73.48 -38.9 65.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.973 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.97 28.2 1.64 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.967 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 7.8 pt-20 -52.31 -51.65 57.43 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.374 0.421 . . . . 0.0 112.005 -175.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.434 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 28.7 p-10 -80.5 -27.53 37.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.653 0.264 . . . . 0.0 110.895 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.2 -49.78 70.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -73.54 -22.32 60.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -67.69 -33.1 74.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.084 0.469 . . . . 0.0 110.061 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 90.9 mt-30 -88.14 -6.17 58.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.413 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.026 -175.339 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.8 m . . . . . 0 C--O 1.234 0.241 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 52.0 Cg_exo -55.13 147.36 54.55 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.016 1.811 . . . . 0.0 111.258 172.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.14 -24.93 34.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 121.182 0.515 . . . . 0.0 110.966 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -59.7 -58.22 9.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.418 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.409 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 33.4 m95 -64.71 138.7 58.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.212 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 1.7 tpp180 -86.0 106.88 17.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.092 0.472 . . . . 0.0 110.743 -176.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.25 122.54 26.44 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.38 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.453 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 65.7 t80 -140.14 119.04 12.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.563 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 56.76 -129.6 1.78 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.111 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -88.4 -4.94 58.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.706 0.289 . . . . 0.0 111.138 -178.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -105.67 169.17 8.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.136 0.493 . . . . 0.0 111.524 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.5 m -139.6 135.54 33.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.149 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 17.4 m-85 -124.43 129.64 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.932 -172.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 40.3 t80 -116.46 114.16 40.48 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.398 175.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.2 Cg_endo -88.77 130.97 2.27 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.334 2.689 . . . . 0.0 112.4 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 123' ' ' SER . 5.8 mp -107.63 140.5 40.56 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.52 60.2 1.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.398 0.618 . . . . 0.0 112.121 -171.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 1.3 t70 82.44 -168.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.292 165.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 65.1 27.44 12.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.099 -178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -141.81 141.44 33.15 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.347 0.594 . . . . 0.0 110.962 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 p -91.94 166.2 12.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.058 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.655 ' CH2' ' HG3' ' A' ' 65' ' ' ARG . 58.7 t90 -64.91 -34.78 79.22 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.3 -177.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.58 -51.88 68.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.34 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.67 -43.49 93.97 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.185 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.536 ' HB3' HD11 ' A' ' 38' ' ' LEU . 69.0 m -55.01 -46.92 75.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.468 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -68.91 -26.05 64.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.942 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -83.66 -30.24 26.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.815 0.341 . . . . 0.0 110.989 178.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.59 -42.68 19.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.569 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.4 m -101.26 128.67 47.28 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 p 154.31 -65.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.668 1.23 . . . . 0.0 108.78 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.52 -19.37 72.75 Favored Glycine 0 C--O 1.227 -0.295 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.917 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.8 mtm -78.53 1.06 23.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.751 0.31 . . . . 0.0 110.564 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.82 -11.88 63.22 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.752 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.49 161.98 13.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.576 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.449 ' HB3' HG23 ' A' ' 76' ' ' VAL . 28.3 m-70 -130.25 170.41 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 27' ' ' SER . 4.5 mm? -56.89 148.44 20.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 173.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.77 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -46.65 106.64 0.09 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.833 0.708 . . . . 0.0 112.57 -174.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.533 HG22 ' CE3' ' A' ' 75' ' ' TRP . 24.3 p -105.9 89.08 2.97 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.182 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.69 110.85 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 110.26 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.6 m -102.34 -30.8 10.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.941 -175.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 32.0 p -131.61 155.25 47.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.461 0.648 . . . . 0.0 112.309 -177.197 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -62.35 -46.78 87.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.988 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.5 -39.2 79.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 43' ' ' THR . 84.1 tt0 -52.46 -57.25 10.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.673 176.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.402 ' O ' HG23 ' A' ' 51' ' ' ILE . 57.2 tt0 -61.04 -50.91 71.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.928 179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -57.22 -31.34 65.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -88.28 -36.53 16.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.1 tp -73.1 -30.25 31.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.836 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.598 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.2 pt -71.67 -4.53 4.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.063 0.459 . . . . 0.0 110.997 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -87.85 -27.26 22.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.932 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -87.91 -22.97 24.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.642 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 73.7 mt -70.54 149.93 46.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.86 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.2 m-20 -57.73 -28.34 63.79 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.928 -177.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.649 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 60.0 mtt180 64.5 20.35 12.12 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.668 0.747 . . . . 0.0 109.273 -168.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HB3' ' HB3' ' A' ' 55' ' ' ASP . 7.3 ttp180 -120.69 -21.7 6.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.076 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -117.85 169.99 9.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.7 p -107.43 122.1 45.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.257 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -104.67 120.51 41.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 -172.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.435 ' HZ ' ' O ' ' A' ' 120' ' ' PHE . 44.7 m-85 -55.19 136.97 48.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.021 0.439 . . . . 0.0 111.851 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 104' ' ' LEU . 78.0 mt -108.21 -175.07 2.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.276 177.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.447 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -96.07 11.35 67.64 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.965 -174.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.559 ' HB3' HG22 ' A' ' 102' ' ' VAL . 28.7 tp -80.05 119.44 22.88 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.655 ' HG3' ' CH2' ' A' ' 24' ' ' TRP . 31.1 ttt-85 -111.81 126.25 54.88 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -133.75 149.95 51.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.428 -0.805 . . . . 0.0 108.945 164.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 2.4 pt-20 -148.46 119.96 7.95 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.007 0.432 . . . . 0.0 110.477 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 58.01 33.97 23.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.613 176.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 67.99 80.79 0.2 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.744 0.653 . . . . 0.0 112.023 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 58.0 mttp -129.03 113.03 14.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.663 175.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.5 59.74 1.2 Allowed Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.088 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -137.59 70.28 1.4 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -61.13 108.66 0.93 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.966 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 55.1 mtm-85 -141.38 172.41 12.72 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.533 ' CE3' HG22 ' A' ' 40' ' ' THR . 97.4 m95 -86.11 173.29 9.95 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 174.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 37' ' ' HIS . 19.6 m -78.33 39.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 111.265 179.304 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 11.3 t70 -164.74 -160.16 0.49 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.441 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 22.4 tp60 -78.67 -6.44 55.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 3.5 m -74.0 120.85 83.39 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.834 -177.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 3.4 Cg_exo -78.34 155.59 28.78 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.946 2.431 . . . . 0.0 111.651 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.86 133.15 51.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.935 0.397 . . . . 0.0 110.368 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 4.1 m-20 -101.44 115.55 64.88 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.67 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.88 -9.59 25.34 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.695 2.263 . . . . 0.0 112.319 177.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.426 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.1 tpp180 -110.1 1.52 18.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.161 0.505 . . . . 0.0 110.238 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.649 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 20.2 mmt180 -128.77 57.29 1.62 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.346 0.593 . . . . 0.0 110.048 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.2 p -138.25 139.67 41.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.609 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -127.51 76.4 1.67 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.716 0.293 . . . . 0.0 110.565 -177.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -67.97 -176.05 0.64 Allowed 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.655 0.741 . . . . 0.0 112.439 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 1.2 m-70 . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.478 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.1 m120 . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 121.019 0.438 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.7 m -119.87 123.25 43.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.045 0.45 . . . . 0.0 110.398 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.2 m -80.77 135.6 24.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.068 0.461 . . . . 0.0 110.526 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.7 m -115.39 147.57 18.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.826 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 28.0 tp -83.16 101.73 11.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 175.279 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.3 p -121.83 145.58 28.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 -174.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.419 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 29.7 t80 -86.08 99.41 11.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.538 177.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.3 t-20 -149.48 137.28 20.33 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 92.2 mt-30 69.83 24.71 5.21 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -171.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.2 t70 71.18 -11.3 0.69 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.098 -1.41 . . . . 0.0 111.637 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HZ2' ' HB2' ' A' ' 112' ' ' ALA . 14.5 ptmm? -109.04 150.67 27.45 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.0 110.304 -178.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.649 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 95.1 m95 -77.42 130.83 37.58 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.432 ' HB2' ' HZ2' ' A' ' 110' ' ' LYS . . . -152.47 156.41 39.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.823 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.554 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 17.8 m0 -81.14 115.31 20.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.37 -178.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -107.03 133.88 51.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -77.89 124.09 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.257 0.348 . . . . 0.0 111.07 -179.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.407 HG21 ' CE1' ' A' ' 120' ' ' PHE . 3.3 m -149.56 158.52 37.71 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.974 176.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -60.89 137.32 71.66 Favored 'Trans proline' 0 CA--C 1.531 0.338 0 C-N-CA 122.282 1.988 . . . . 0.0 111.787 175.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.554 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 41.8 m -64.67 -23.85 67.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.39 15.14 18.42 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.023 -0.423 . . . . 0.0 111.169 -174.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.495 ' CZ ' ' HB2' ' A' ' 122' ' ' ALA . 0.1 OUTLIER -84.55 140.42 31.43 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.91 128.45 35.54 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.788 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.495 ' HB2' ' CZ ' ' A' ' 120' ' ' PHE . . . -161.87 -169.24 2.16 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.242 0.544 . . . . 0.0 111.261 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.544 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 14.5 m -96.6 -176.58 3.65 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.615 177.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.455 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 13.9 ptt-85 -165.41 170.08 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.045 0.45 . . . . 0.0 111.35 177.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.0 mt -122.35 135.73 61.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 6.1 t -103.43 129.16 50.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -111.95 113.08 25.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.823 -171.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.752 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.5 tt -124.85 138.78 32.04 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-O 120.867 0.365 . . . . 0.0 110.883 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -70.08 167.54 24.58 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 123.15 2.567 . . . . 0.0 111.99 170.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.56 93.37 0.14 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.715 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.3 p -78.21 33.22 0.19 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 21.4 p -67.36 -17.13 64.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.996 0.427 . . . . 0.0 110.837 176.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 78.9 mt -73.38 -18.14 61.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.568 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -88.67 -56.52 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 110.071 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.58 29.05 1.36 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.297 -175.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -63.12 -55.81 22.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -175.788 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.45 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 5.3 p30 -80.86 -22.84 39.54 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.31 -39.48 93.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.394 177.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -81.6 -30.78 32.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.31 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -67.73 -31.2 70.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.755 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -86.76 -5.41 59.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.74 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.36 -175.657 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 65.3 m . . . . . 0 C--O 1.233 0.234 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 51.9 Cg_exo -53.83 148.53 37.03 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.057 1.838 . . . . 0.0 111.453 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.82 -29.93 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.925 0.393 . . . . 0.0 111.356 -172.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.09 -29.91 71.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.692 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 23.6 m95 -88.26 125.83 34.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.583 -174.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 8' ' ' ARG . 16.6 tpt180 -73.6 99.86 3.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.195 0.522 . . . . 0.0 110.063 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.37 129.46 39.83 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.86 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.435 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 85.9 t80 -132.69 105.79 7.39 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.426 177.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 56.96 -103.57 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.786 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.2 t -91.25 -37.94 12.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.626 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -92.65 174.33 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.136 0.493 . . . . 0.0 111.729 -173.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HB2' HG22 ' A' ' 128' ' ' ILE . 78.2 m -141.2 127.5 19.79 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.407 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.435 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 53.7 m-85 -120.58 127.25 51.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.386 -171.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.8 t80 -117.94 114.66 37.17 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.781 0.324 . . . . 0.0 110.408 176.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 5.2 Cg_endo -88.11 128.01 2.22 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.247 2.631 . . . . 0.0 112.075 176.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.05 138.57 48.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.009 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 p -89.43 2.69 54.14 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.527 0.68 . . . . 0.0 109.408 173.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 22' ' ' LYS . 3.9 t70 -66.48 133.52 50.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.002 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.703 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 16.5 p-10 -93.09 107.03 18.91 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.849 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.936 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 14.4 mptt -136.83 156.08 48.96 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.833 177.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 76.4 p -76.46 167.57 21.61 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.653 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.5 t90 -58.89 -39.2 80.73 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.941 0.4 . . . . 0.0 110.771 -176.011 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.09 76.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.186 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.97 -34.48 77.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.044 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.9 t -58.45 -46.33 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.866 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -74.9 -22.46 58.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.76 0.314 . . . . 0.0 110.39 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -67.66 -45.81 74.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.782 0.325 . . . . 0.0 110.744 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.407 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.7 t-20 -71.97 -28.7 63.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.201 0.524 . . . . 0.0 109.949 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.52 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 65.3 m -84.13 177.13 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.41 ' HB3' ' O ' ' A' ' 31' ' ' CYS . 33.2 t 75.33 -34.82 0.26 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.017 0.527 . . . . 0.0 110.919 -177.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.67 -29.27 71.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.97 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.52 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.5 pmm? -100.47 10.51 41.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.331 . . . . 0.0 110.368 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.75 19.82 67.17 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.524 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.829 ' HB2' HG12 ' A' ' 128' ' ' ILE . . . -113.79 172.77 6.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.658 0.266 . . . . 0.0 111.39 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.468 ' HD2' ' OD1' ' A' ' 77' ' ' ASP . 71.3 m-70 -140.48 169.2 18.11 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.221 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' HG23 ' A' ' 40' ' ' THR . 4.1 mm? -52.44 141.02 20.86 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.371 0.419 . . . . 0.0 110.922 173.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.572 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.8 tpt -36.26 111.15 0.13 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.145 0.903 . . . . 0.0 112.439 177.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.647 HG21 ' HB3' ' A' ' 77' ' ' ASP . 12.0 p -111.89 89.01 2.94 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.522 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.567 ' HA ' ' OE2' ' A' ' 46' ' ' GLU . 41.9 mt -64.65 114.83 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.486 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m -106.9 -22.78 12.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.832 -177.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.597 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 13.1 p -132.96 151.9 52.0 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.362 1.077 . . . . 0.0 113.182 -178.413 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.96 -50.63 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.548 -179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -59.36 -39.41 83.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.542 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' ' 43' ' ' THR . 61.8 tt0 -48.5 -58.93 3.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.183 176.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.505 ' HA ' HG22 ' A' ' 50' ' ' ILE . 23.0 tt0 -61.18 -44.66 96.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.932 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -61.96 -25.42 67.6 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -177.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 27.5 m-85 -88.53 -37.81 15.42 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.3 tp -71.88 -30.01 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 120.381 -0.528 . . . . 0.0 111.103 -176.376 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.465 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.8 pt -69.44 -5.79 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.032 0.444 . . . . 0.0 111.196 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -87.22 -25.29 24.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.211 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -92.97 -23.81 18.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.494 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.7 mt -76.55 144.43 39.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.043 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.556 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -78.65 138.2 38.19 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.56 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 84.8 mtt180 -83.46 11.68 6.63 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -170.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.859 ' HG2' HD22 ' A' ' 58' ' ' LEU . 7.3 ptp180 -112.11 -11.08 13.84 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.755 176.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.859 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -100.22 166.91 10.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.271 0.558 . . . . 0.0 111.609 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.3 m -127.17 124.09 38.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.035 175.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.702 ' HB3' HG13 ' A' ' 125' ' ' ILE . 80.6 m-85 -109.07 121.95 46.23 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -169.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.463 ' HA ' HG12 ' A' ' 103' ' ' VAL . 19.1 m-85 -62.38 138.94 58.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.725 0.297 . . . . 0.0 111.791 177.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.626 HD23 HG12 ' A' ' 102' ' ' VAL . 1.4 mm? -110.92 173.36 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 174.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.641 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -87.73 60.65 4.19 Favored Glycine 0 C--O 1.225 -0.414 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.315 -177.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.461 HD23 ' HB ' ' A' ' 102' ' ' VAL . 3.3 mm? -109.55 126.42 53.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.724 0.262 . . . . 0.0 110.329 177.107 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.504 ' NH1' ' HB3' ' A' ' 67' ' ' GLU . 16.5 ttp85 -110.87 117.53 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.422 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -136.49 84.85 2.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.982 0.896 . . . . 0.0 108.998 164.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NH1' ' A' ' 65' ' ' ARG . 3.3 tm-20 -91.15 123.82 34.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.499 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.404 ' HB3' ' NZ ' ' A' ' 70' ' ' LYS . 3.2 t-20 71.28 19.94 5.19 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.867 0.73 . . . . 0.0 110.191 178.129 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.37 75.14 0.33 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.127 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 52.0 mttp -101.95 -22.56 14.27 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.654 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 -8.17 62.79 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.568 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -86.07 65.14 8.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.554 0.692 . . . . 0.0 110.289 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -61.16 113.82 2.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.177 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -133.32 151.01 51.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.737 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 75.4 m95 -84.61 136.96 33.55 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.439 HG21 ' CZ2' ' A' ' 24' ' ' TRP . 10.5 t -79.2 47.98 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.662 0.744 . . . . 0.0 110.809 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.647 ' HB3' HG21 ' A' ' 40' ' ' THR . 33.9 t70 -162.09 32.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -178.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? 76.76 -37.29 0.28 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.279 -1.328 . . . . 0.0 111.586 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 24.2 m -43.26 122.29 3.27 Favored Pre-proline 0 C--O 1.239 0.505 0 CA-C-O 121.531 0.681 . . . . 0.0 112.664 -176.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.8 Cg_exo -72.04 148.15 50.27 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 123.309 2.673 . . . . 0.0 111.644 174.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 75' ' ' TRP . 68.0 t80 -69.86 127.91 34.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.253 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.473 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 0.9 OUTLIER -89.65 115.98 65.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.347 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.65 -29.15 36.73 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.63 2.22 . . . . 0.0 112.651 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -90.09 -22.56 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.802 0.334 . . . . 0.0 111.249 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.473 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 86.4 mtt180 -105.92 76.91 1.21 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.512 0.673 . . . . 0.0 110.484 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.0 p -136.41 131.02 47.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.944 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -126.39 52.05 1.76 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.909 -168.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.425 ' CH2' HG22 ' A' ' 102' ' ' VAL . 85.8 m95 -64.81 177.95 0.87 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.454 0.645 . . . . 0.0 111.372 178.273 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.495 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 91.0 m-70 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.536 172.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.493 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.2 p-10 . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 121.529 0.68 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.37 166.34 28.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.464 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.626 HG12 HD23 ' A' ' 62' ' ' LEU . 59.1 t -95.71 139.88 18.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -169.12 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.6 m -123.9 141.45 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.718 168.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.51 ' N ' HD21 ' A' ' 62' ' ' LEU . 13.9 tp -81.53 109.99 16.5 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.38 140.46 49.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.57 -172.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.56 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 66.5 t80 -88.25 96.09 10.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.495 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 49.5 t-20 -129.33 128.53 43.31 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -176.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 61.45 38.79 15.67 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.856 0.722 . . . . 0.0 109.987 -175.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 10.5 m-20 65.56 16.9 10.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.246 -1.343 . . . . 0.0 113.15 174.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HE2' ' HB2' ' A' ' 110' ' ' LYS . 10.9 ptmm? -132.49 137.09 47.08 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.903 172.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.465 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -70.8 130.35 41.46 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 170.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -157.0 168.81 26.38 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.471 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.404 ' HB3' HG13 ' A' ' 102' ' ' VAL . 37.0 m0 -79.15 142.16 36.61 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.292 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -136.25 122.17 20.04 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 13.5 t70 -84.17 123.6 30.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.702 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.449 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 21.3 m -139.23 159.94 64.27 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.458 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.476 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 13.1 Cg_endo -57.38 131.32 44.04 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.53 2.153 . . . . 0.0 111.942 175.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 69.5 m -67.19 -12.75 60.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.19 0.519 . . . . 0.0 110.657 177.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -85.77 -2.78 58.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.55 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.476 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 83.5 t80 -88.0 138.35 31.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.109 175.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.96 135.91 33.73 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.906 0.384 . . . . 0.0 110.252 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.441 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -154.14 -173.21 4.49 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.969 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 39.2 m -74.29 160.45 31.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.985 0.421 . . . . 0.0 110.088 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.936 ' HD2' ' HB2' ' A' ' 22' ' ' LYS . 48.4 mtp180 -127.26 145.85 50.63 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.587 -169.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.702 HG13 ' HB3' ' A' ' 60' ' ' TYR . 59.0 mt -124.65 119.63 56.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 166.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.54 132.8 53.47 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -112.91 126.54 55.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.075 0.464 . . . . 0.0 111.961 -174.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.829 HG12 ' HB2' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -111.38 134.74 21.09 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.941 175.562 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HD13 ' A' ' 128' ' ' ILE . 6.6 Cg_exo -74.11 158.63 45.35 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.113 1.875 . . . . 0.0 111.164 173.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.41 49.59 2.33 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.9 t -111.12 18.08 19.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.08 0.467 . . . . 0.0 110.521 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.2 m -60.53 -21.91 63.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.227 0.536 . . . . 0.0 111.258 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 133' ' ' LEU . 3.9 mp -75.91 -28.9 58.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.102 179.121 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -87.82 -43.17 12.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.871 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -85.79 61.13 6.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.172 -177.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -43.37 74.2 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.2 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -74.8 -30.08 61.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.563 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tt -64.91 -45.28 86.53 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.82 -30.55 71.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.278 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -71.95 -35.64 69.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.812 178.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -86.64 -6.11 58.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.998 -176.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.252 1.226 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.785 -177.618 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.754 ' SG ' ' HD2' ' A' ' 4' ' ' PRO . 3.0 t . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.754 ' HD2' ' SG ' ' A' ' 3' ' ' CYS . 18.5 Cg_endo -64.96 119.42 6.45 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 N-CA-C 108.859 -1.247 . . . . 0.0 108.859 164.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.411 HG22 ' N ' ' A' ' 6' ' ' ASP . 5.3 mp 60.19 159.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -166.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.411 ' N ' HG22 ' A' ' 5' ' ' ILE . 10.7 t70 -79.96 72.76 6.74 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.117 -0.989 . . . . 0.0 110.394 -177.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.454 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 10.4 m0 -73.23 155.34 39.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.179 174.241 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 8' ' ' ARG . 18.3 tpt180 -72.87 102.07 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.067 0.461 . . . . 0.0 110.063 -177.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -87.19 124.91 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.112 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.47 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 66.9 t80 -120.36 110.98 17.18 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.177 174.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 66.88 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.101 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -149.07 17.33 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.926 0.393 . . . . 0.0 110.625 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.481 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 36.8 m-80 -125.92 151.01 47.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.463 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.758 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 80.3 m -106.25 135.03 48.45 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.325 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 27.7 m-85 -129.24 134.72 48.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.511 ' HD2' HD22 ' A' ' 18' ' ' LEU . 8.4 t80 -123.73 113.23 28.77 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.9 Cg_endo -89.68 118.35 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.533 2.822 . . . . 0.0 111.858 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -132.24 140.47 48.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.371 0.605 . . . . 0.0 110.389 178.373 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 p -86.99 5.29 38.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.299 -169.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 18' ' ' LEU . 2.8 m-20 -59.56 135.04 57.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.052 0.453 . . . . 0.0 110.174 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.676 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 2.1 p-10 -96.28 102.3 14.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.022 -176.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.676 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 13.4 mmmt -137.07 155.52 49.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 179.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.7 p -70.72 178.98 2.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.834 -176.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.559 ' CZ2' HG23 ' A' ' 76' ' ' VAL . 49.4 t90 -56.54 -52.7 63.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.12 0.486 . . . . 0.0 110.444 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.633 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -67.04 -43.72 82.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.293 -177.294 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.28 -31.54 64.13 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -174.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 p -67.26 -35.26 79.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.581 175.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' HB2' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -66.25 -30.98 71.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.739 173.975 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.633 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 11.1 mmt-85 -83.24 -25.59 31.55 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.105 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -77.61 -26.39 50.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.7 m -85.87 178.88 7.15 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 166.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.743 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 6.9 p 81.39 -41.23 0.15 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.79 0.836 . . . . 0.0 111.565 172.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.81 -23.09 58.49 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 116.202 -0.454 . . . . 0.0 113.008 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -100.62 15.73 27.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.658 0.266 . . . . 0.0 110.914 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.18 47.59 7.43 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.2 -175.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -142.98 -174.37 4.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.835 0.35 . . . . 0.0 110.649 -173.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.653 ' CD2' ' HB2' ' A' ' 77' ' ' ASP . 9.6 t60 -148.48 162.16 40.18 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 171.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 28' ' ' GLU . 21.9 tp -56.95 145.73 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.4 113.67 2.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.542 0.686 . . . . 0.0 112.443 -173.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -106.92 109.71 21.67 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.252 170.164 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.2 mt -64.6 111.68 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.975 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.1 m -97.16 -31.65 12.35 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.787 -174.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 21.9 p -128.04 153.27 46.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.85 0.833 . . . . 0.0 112.433 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.443 ' CG ' ' HG2' ' A' ' 85' ' ' ARG . 19.3 mt-10 -66.69 -36.12 81.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.965 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.11 79.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.033 0.444 . . . . 0.0 110.425 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.565 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.8 tt0 -55.58 -54.54 42.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.42 ' O ' HG23 ' A' ' 51' ' ' ILE . 21.5 tm0? -57.74 -48.86 78.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.641 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -64.02 -27.73 69.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.277 -176.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -89.23 -41.24 12.32 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.9 tp -62.51 -35.52 70.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 -176.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.65 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 41.5 pt -68.1 -9.22 10.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.497 -178.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -82.81 -30.0 29.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.24 -28.8 25.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.694 -178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 69.4 mt -62.86 158.02 20.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.505 ' OD2' ' HB3' ' A' ' 57' ' ' ARG . 15.8 t70 -78.88 -2.45 39.92 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.994 -1.003 . . . . 0.0 112.975 -171.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.719 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 10.9 mpt_? 64.94 -57.51 0.27 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -172.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HB3' ' OD2' ' A' ' 55' ' ' ASP . 13.5 ttp180 -61.99 -27.73 69.07 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 122.982 0.513 . . . . 0.0 111.864 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.51 147.32 24.04 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.367 0.603 . . . . 0.0 112.243 -175.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.9 m -100.93 130.54 46.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.72 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 123' ' ' SER . 86.2 m-85 -112.94 124.34 52.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -174.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -69.99 127.93 34.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.033 174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.562 HD21 ' HB2' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -169.71 -177.48 2.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.648 179.334 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.414 ' HA2' ' CZ3' ' A' ' 75' ' ' TRP . . . 83.77 -115.03 3.98 Favored Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 115.23 0.852 . . . . 0.0 115.23 163.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 75' ' ' TRP . 3.2 mm? -93.67 154.32 17.88 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.132 -0.534 . . . . 0.0 110.577 -170.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.456 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 14.0 ttm180 -93.6 104.33 16.45 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.72 ' HB2' ' HA ' ' A' ' 101' ' ' CYS . 5.4 m-20 -97.0 75.4 2.64 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.993 0.902 . . . . 0.0 108.778 178.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 13.8 tt0 -112.39 121.16 44.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 114.574 -1.193 . . . . 0.0 110.624 -171.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 67.86 15.87 9.61 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.469 0.48 . . . . 0.0 110.688 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.91 35.1 24.85 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.492 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 23.8 mttm -64.46 137.21 57.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.407 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -68.59 -15.32 68.38 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.064 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.95 86.0 7.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.693 ' HZ3' ' HA ' ' A' ' 66' ' ' ASP . 71.9 m95 -75.54 133.7 40.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.09 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.568 HH21 ' HA ' ' A' ' 78' ' ' GLN . 73.2 ttt180 -150.47 149.11 29.56 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.502 ' HA ' HD13 ' A' ' 64' ' ' LEU . 78.0 m95 -69.66 169.92 11.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.34 0.591 . . . . 0.0 111.01 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 40' ' ' THR . 8.8 p -62.57 -19.31 22.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.714 -178.097 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.653 ' HB2' ' CD2' ' A' ' 37' ' ' HIS . 20.5 t70 -147.67 103.57 3.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.471 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.568 ' HA ' HH21 ' A' ' 74' ' ' ARG . 45.4 tp60 64.88 -64.68 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 7.4 m -42.99 127.89 3.25 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 124.206 1.002 . . . . 0.0 112.963 -173.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.7 Cg_exo -74.89 159.68 41.44 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.087 2.525 . . . . 0.0 111.687 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -54.64 133.07 46.57 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.752 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.462 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 11.0 t-20 -103.97 128.4 27.29 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.658 -175.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.3 Cg_exo -67.92 -36.25 18.46 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.01 2.474 . . . . 0.0 113.904 -177.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 33.0 ttp180 -96.13 -34.73 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.623 -176.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.443 ' HG2' ' CG ' ' A' ' 44' ' ' GLU . 95.8 mtt180 -93.14 25.4 3.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.301 0.572 . . . . 0.0 110.814 -172.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 86' ' ' VAL . 6.0 p -90.88 95.39 5.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.978 0.894 . . . . 0.0 109.619 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.25 73.36 10.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.291 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 25.5 m95 -66.75 166.64 12.73 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.499 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.586 ' NE2' ' HB3' ' A' ' 107' ' ' ASN . 6.2 t-80 . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.537 -172.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.677 ' HB2' ' OD2' ' A' ' 115' ' ' ASP . 6.6 p30 . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.111 0.482 . . . . 0.0 110.311 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.72 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 93.2 m -46.86 131.21 11.99 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.077 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.84 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 10.4 m -80.14 144.17 11.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.582 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.647 HG11 ' HE1' ' A' ' 120' ' ' PHE . 28.0 m -130.62 150.01 34.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.787 170.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.562 ' HB2' HD21 ' A' ' 62' ' ' LEU . 14.7 tp -83.88 110.53 18.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 11.1 p -134.46 152.31 33.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 -176.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.711 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 20.0 t80 -87.61 96.85 10.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.649 177.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASN . . . . . 0.586 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 57.6 t30 -133.65 145.59 50.11 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 63.89 16.06 9.57 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.432 0.457 . . . . 0.0 110.414 -176.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.8 t70 78.0 19.55 1.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.136 0.897 . . . . 0.0 111.624 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' HE3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -141.74 156.29 45.61 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.391 -0.818 . . . . 0.0 111.599 173.643 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.719 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.7 m95 -85.54 128.54 34.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.716 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -165.27 174.46 10.16 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.64 175.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.84 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 30.3 m0 -80.17 124.48 28.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.97 0.414 . . . . 0.0 111.165 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.423 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 8.0 t-20 -99.55 142.25 31.27 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.372 176.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.677 ' OD2' ' HB2' ' A' ' 100' ' ' ASN . 14.4 t70 -84.84 122.65 29.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.418 HG21 ' CE1' ' A' ' 120' ' ' PHE . 0.6 OUTLIER -151.27 149.04 23.66 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 111.54 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 120' ' ' PHE . 8.2 Cg_endo -53.01 144.84 44.06 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.883 2.389 . . . . 0.0 111.52 172.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 26.4 m -81.97 -14.41 56.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.576 -170.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -80.4 -8.95 59.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.459 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.647 ' HE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -74.07 133.62 42.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 170.854 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -112.73 146.26 39.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.471 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.451 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.45 -168.6 3.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.365 -176.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 8.5 t -69.35 166.66 18.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.696 HH11 ' HB2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -153.35 161.84 41.91 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -168.152 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.417 HD11 HD21 ' A' ' 54' ' ' LEU . 68.1 mt -136.55 133.94 49.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.101 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 75.8 m -102.6 142.25 34.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 173.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -121.81 136.01 54.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.852 0.358 . . . . 0.0 110.807 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.758 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 56.2 mt -125.23 135.28 26.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.754 177.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.19 157.21 29.94 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.065 1.843 . . . . 0.0 111.45 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.24 58.19 1.92 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.464 179.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.0 t -69.26 -20.9 63.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 111.568 0.211 . . . . 0.0 111.568 -176.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.6 m -66.09 -26.54 67.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.142 0.496 . . . . 0.0 110.617 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.441 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.8 mp -90.32 -20.84 22.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.368 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.01 -28.46 22.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.429 0.633 . . . . 0.0 109.35 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.67 39.31 0.95 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.716 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -64.32 -49.56 71.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.851 -174.699 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -83.2 -26.8 30.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.011 0.434 . . . . 0.0 110.267 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 58.1 mt -62.54 -52.59 62.85 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.601 178.289 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -75.05 -19.3 60.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.279 0.562 . . . . 0.0 110.057 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.02 -39.71 95.56 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -87.76 -44.53 11.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.271 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.46 -177.764 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.2 m . . . . . 0 C--O 1.234 0.253 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PRO . . . . . 0.446 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 41.1 Cg_exo -57.27 149.15 66.28 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.489 2.126 . . . . 0.0 112.155 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.74 -14.84 18.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.403 0.621 . . . . 0.0 111.132 -176.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.7 -30.61 67.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.262 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.553 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 23.0 m95 -90.96 161.47 15.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.015 -173.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 50.3 mmt-85 -115.7 136.19 53.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.931 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -102.91 135.83 43.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.916 0.389 . . . . 0.0 111.579 -176.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.45 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 73.6 t80 -137.97 110.18 7.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.621 175.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 66.0 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.209 -176.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.6 m -151.92 30.19 0.57 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.268 0.556 . . . . 0.0 109.759 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.471 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 17.7 m-80 -129.02 149.9 50.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.384 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 85.5 m -124.89 127.14 46.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 109.928 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.45 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 5.6 m-85 -117.0 141.59 48.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.194 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.553 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 26.4 t80 -128.74 114.9 19.25 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-O 120.73 0.3 . . . . 0.0 110.367 175.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -88.79 138.41 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.998 2.465 . . . . 0.0 112.23 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.45 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 5.1 mp -122.48 149.66 43.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.093 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 20' ' ' ASP . 2.6 p -101.16 66.29 1.12 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.886 -167.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.448 ' HA ' ' C ' ' A' ' 122' ' ' ALA . 32.0 t70 81.42 178.39 0.08 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.708 165.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 0.5 OUTLIER 86.57 15.23 0.11 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.569 1.147 . . . . 0.0 112.326 174.828 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.837 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 70.0 mmtt -139.28 148.23 42.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.95 0.405 . . . . 0.0 111.376 176.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.6 p -85.17 172.2 11.39 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 75.4 t90 -62.16 -39.96 94.37 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.09 -58.14 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.229 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.837 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 52.2 mm-40 -56.7 -37.75 71.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.538 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.556 ' HB3' HD21 ' A' ' 38' ' ' LEU . 71.7 m -54.59 -50.73 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.538 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 31' ' ' CYS . 9.0 tp10 -81.11 -21.66 39.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.737 0.303 . . . . 0.0 110.767 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 99.2 mtt180 -65.67 -42.98 90.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.074 0.464 . . . . 0.0 110.066 172.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -74.59 -28.22 60.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.226 178.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 81.4 m -84.33 178.54 7.73 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.149 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.2 m 71.78 -45.66 0.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.67 0.388 . . . . 0.0 111.077 -174.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.96 -18.39 70.66 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.2 -0.524 . . . . 0.0 111.965 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.6 mtm -97.99 3.82 49.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.329 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.9 89.45 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.89 -0.672 . . . . 0.0 111.891 -175.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -100.36 -176.58 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.722 -0.239 . . . . 0.0 110.873 -178.185 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -149.31 165.09 33.02 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.242 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 27' ' ' SER . 33.2 mt -60.32 144.81 49.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.069 0.461 . . . . 0.0 111.442 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.431 ' CE ' HG12 ' A' ' 41' ' ' ILE . 0.5 OUTLIER -57.79 120.02 7.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.982 -175.727 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.535 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 53.9 p -116.86 101.91 8.94 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.646 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.431 HG12 ' CE ' ' A' ' 39' ' ' MET . 39.2 mt -64.8 109.2 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.212 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 m -95.78 -37.83 10.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.462 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.9 p -125.66 154.09 42.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.545 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -68.39 -30.23 69.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.447 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.38 -47.27 86.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.198 175.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -53.18 -47.35 68.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.277 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -60.82 -53.57 55.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.15 176.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -57.81 -31.02 66.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.433 -174.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.447 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 34.1 m-85 -82.56 -39.24 22.56 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.7 tp -73.28 -32.22 36.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.576 -0.45 . . . . 0.0 111.35 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.428 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 34.6 pt -69.34 -9.07 11.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.478 . . . . 0.0 111.234 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -78.64 -27.42 45.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.161 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -91.51 -27.67 18.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.801 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.0 mt -68.95 134.32 49.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.663 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.436 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.7 t70 -61.5 128.74 37.78 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 171.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.554 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 64.9 mtt180 -85.48 32.02 0.58 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -168.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.855 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.0 ptp180 -127.03 -24.45 3.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.507 174.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.855 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -86.31 162.3 18.3 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.277 0.561 . . . . 0.0 112.074 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.434 ' HB2' HG21 ' A' ' 103' ' ' VAL . 4.6 p -112.55 112.74 24.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 174.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 125' ' ' ILE . 62.7 m-85 -99.36 120.74 40.07 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.715 ' HA ' HG12 ' A' ' 103' ' ' VAL . 24.3 m-85 -59.12 128.99 39.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.071 0.462 . . . . 0.0 111.734 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.821 HD11 ' HG ' ' A' ' 104' ' ' LEU . 98.9 mt -103.53 157.43 17.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.194 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.604 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -78.98 39.39 2.03 Favored Glycine 0 C--O 1.223 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 113.333 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.642 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.2 tp -105.04 116.35 31.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.414 0.607 . . . . 0.0 109.621 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.3 ttt85 -115.03 127.73 55.83 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -172.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -122.91 107.37 11.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.695 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.4 tt0 -99.71 118.73 36.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.679 -172.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.0 m120 69.0 21.5 7.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.431 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.94 70.07 0.68 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.687 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.695 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 61.1 mttp -91.59 -16.77 26.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.949 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.77 12.63 82.8 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -109.43 74.99 0.92 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.058 -0.571 . . . . 0.0 109.656 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.641 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.7 m95 -66.68 104.23 1.26 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 178.223 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -123.68 144.62 49.53 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 -174.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TRP . . . . . 0.604 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 89.8 m95 -85.99 131.66 34.23 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.1 p -57.82 -27.92 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.989 -175.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.515 ' HB3' HG21 ' A' ' 40' ' ' THR . 2.3 t70 -55.92 -62.43 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.039 173.65 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.437 ' HB2' ' O ' ' A' ' 77' ' ' ASP . 21.8 tm0? 163.44 -29.89 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.6 m -42.08 121.74 2.48 Favored Pre-proline 0 C--O 1.235 0.333 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.09 -178.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 23.7 Cg_exo -66.96 161.28 43.2 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.647 2.231 . . . . 0.0 111.385 173.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 56.5 t80 -69.02 142.46 54.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.833 -178.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.481 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 45.0 m-80 -103.1 96.84 8.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.305 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 17.7 Cg_exo -67.33 -29.85 37.75 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.519 2.146 . . . . 0.0 111.539 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -81.04 -11.66 59.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.629 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ARG . . . . . 0.481 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 92.2 mtt180 -129.44 55.51 1.76 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.176 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.73 138.06 27.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.924 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -130.77 71.6 1.47 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.298 -177.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -75.84 168.95 19.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.486 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 3.9 m80 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.024 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.38 0.61 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.11 148.24 28.06 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.306 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 64' ' ' LEU . 20.9 m -88.56 147.21 5.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.209 0.528 . . . . 0.0 111.344 -176.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.715 HG12 ' HA ' ' A' ' 61' ' ' PHE . 34.5 m -118.59 152.76 20.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.411 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.821 ' HG ' HD11 ' A' ' 62' ' ' LEU . 17.4 mt -83.09 103.41 12.5 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.429 HG13 ' CE1' ' A' ' 89' ' ' HIS . 7.2 p -123.01 138.34 53.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.488 -178.229 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -87.71 96.52 10.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.478 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -140.88 147.17 38.49 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 64.4 24.25 13.15 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.648 0.593 . . . . 0.0 109.705 -172.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 66.59 22.6 10.5 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.315 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -134.41 151.31 51.11 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.969 -0.457 . . . . 0.0 111.199 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TRP . . . . . 0.554 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 81.9 m95 -88.71 108.6 19.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.509 171.204 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.486 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -143.45 165.76 26.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.93 -178.297 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.582 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.3 m0 -78.0 125.67 29.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.39 -177.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -121.99 125.7 46.9 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 20.0 t70 -84.17 128.08 34.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.213 0.53 . . . . 0.0 111.744 -173.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.59 159.03 69.21 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.552 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.57 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.4 Cg_endo -55.85 137.93 80.23 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.384 2.056 . . . . 0.0 111.929 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 90.1 m -69.74 -9.1 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -178.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -98.85 13.24 33.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.627 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.57 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 61.9 t80 -89.08 140.36 29.53 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.611 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -82.57 125.13 30.81 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 177.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.569 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -157.49 -167.25 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.044 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 20.0 m -84.46 175.04 9.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 1.1 ptm180 -154.83 155.43 34.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.761 0.315 . . . . 0.0 111.733 -173.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.566 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.2 mt -127.9 123.82 61.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.128 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.9 t -106.53 134.84 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -119.09 125.76 50.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.94 -177.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ILE . . . . . 0.445 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 11.0 tt -112.08 141.39 24.86 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -68.51 146.5 68.18 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 121.886 1.724 . . . . 0.0 111.029 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.54 63.12 1.87 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.712 176.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.0 t -80.92 22.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.813 0.816 . . . . 0.0 110.946 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.518 ' O ' ' HB3' ' A' ' 136' ' ' GLU . 5.9 t -66.99 -11.25 56.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.385 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.793 HD23 ' H ' ' A' ' 133' ' ' LEU . 1.9 pt? -74.38 -41.35 61.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.333 0.587 . . . . 0.0 109.989 176.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ASN . . . . . 0.415 ' N ' ' HG ' ' A' ' 133' ' ' LEU . 9.8 t30 -87.83 -46.77 9.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.869 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.02 21.0 3.89 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 132' ' ' THR . 0.0 OUTLIER -58.58 -59.32 5.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.738 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 6.5 p30 -71.86 -26.69 62.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.122 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.95 -48.32 76.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -70.99 -25.58 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.146 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -70.32 -39.66 74.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.866 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.6 mm-40 -75.11 -7.37 53.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.366 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.669 177.582 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.413 HG13 ' HB ' ' A' ' 132' ' ' THR . 4.4 p -103.88 118.51 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 170.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 78.4 m -148.05 156.45 43.69 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.724 -173.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.457 ' O ' ' HD1' ' A' ' 7' ' ' TRP . 59.6 Cg_endo -73.23 128.44 12.94 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.696 2.264 . . . . 0.0 114.752 -172.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mt 65.15 -98.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.735 167.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -114.56 9.79 16.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 111.849 -164.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.564 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.5 m95 -68.29 119.7 13.25 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.508 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 52.7 mmt-85 -72.68 112.11 8.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.689 0.281 . . . . 0.0 110.77 -175.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.83 121.64 24.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 77.9 t80 -139.72 121.69 15.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 60.02 -99.57 0.09 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.398 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 -11.92 9.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.93 0.395 . . . . 0.0 110.492 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -97.46 174.14 6.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.911 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.564 ' HB3' ' HB3' ' A' ' 7' ' ' TRP . 79.5 m -137.79 131.34 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.505 175.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.408 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 46.3 m-85 -120.62 123.86 43.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.872 -174.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 75.5 t80 -118.53 116.95 34.76 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.177 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.5 Cg_endo -84.93 135.33 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.156 2.571 . . . . 0.0 112.358 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.7 mp -122.73 139.35 54.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 p -108.03 22.83 15.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.13 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -87.47 170.32 11.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.123 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -96.04 115.92 28.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.398 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.411 ' HA ' ' OE2' ' A' ' 121' ' ' GLU . 3.5 mmpm? -148.31 146.58 28.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.8 p -73.99 167.44 21.51 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.623 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 57.9 t90 -65.96 -35.14 79.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.54 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.97 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 31.8 mt-10 -76.86 -32.03 57.22 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.533 ' HB2' HD21 ' A' ' 38' ' ' LEU . 7.1 p -68.55 -39.6 81.03 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.576 177.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.9 -33.67 76.37 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.926 173.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.46 ' HB3' ' HA ' ' A' ' 26' ' ' GLU . 8.2 ttt180 -73.03 -42.05 63.57 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.099 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.48 -32.0 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.246 0.546 . . . . 0.0 109.999 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.9 m -84.82 178.15 7.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 170.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 40.2 m 75.86 -44.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.729 0.412 . . . . 0.0 111.061 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.96 -23.9 66.27 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.955 173.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -91.05 7.27 41.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.688 0.28 . . . . 0.0 110.608 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.13 90.7 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.44 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.665 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -101.44 -176.39 3.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.344 -0.428 . . . . 0.0 111.026 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.54 ' ND1' ' HA ' ' A' ' 77' ' ' ASP . 34.0 m170 -143.76 170.66 15.45 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 174.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 27' ' ' SER . 61.1 mt -68.15 163.12 23.32 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.264 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.958 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.4 tpt -53.85 102.33 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.27 0.557 . . . . 0.0 111.799 -177.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.585 HG22 ' HB3' ' A' ' 75' ' ' TRP . 18.3 p -105.55 104.95 14.77 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.127 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 55.5 mt -74.8 95.32 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.892 -175.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.98 -41.26 36.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.868 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 44.9 p -123.65 161.18 25.58 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.907 0.861 . . . . 0.0 111.675 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.93 -16.47 64.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.876 175.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.712 ' HA ' ' OD1' ' A' ' 48' ' ' ASN . . . -79.67 -38.23 34.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.215 174.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -48.38 -49.37 34.89 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.45 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -66.56 -56.36 11.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.857 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.712 ' OD1' ' HA ' ' A' ' 45' ' ' ALA . 0.1 OUTLIER -65.97 -25.14 66.97 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -170.202 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -87.26 -35.0 18.74 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.624 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -71.45 -31.72 43.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 120.271 -0.572 . . . . 0.0 111.201 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.4 pt -71.48 -4.67 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.935 0.397 . . . . 0.0 111.111 -179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -86.91 -19.46 28.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.645 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.13 -17.48 17.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.235 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.8 mt -82.83 144.19 30.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.287 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.94 133.34 40.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.982 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -76.43 53.26 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.786 -175.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.625 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -162.47 -31.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.201 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.625 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -87.17 158.97 19.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.22 0.534 . . . . 0.0 111.267 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.8 m -110.51 121.02 44.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.223 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 84.0 m-85 -107.4 123.74 48.81 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.824 ' HA ' HG12 ' A' ' 103' ' ' VAL . 49.2 m-85 -57.89 137.99 56.17 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.753 HD21 ' HG ' ' A' ' 104' ' ' LEU . 85.1 mt -105.14 163.66 12.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.249 173.236 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.62 14.75 34.31 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.623 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.533 ' HG ' ' CE2' ' A' ' 75' ' ' TRP . 1.1 mt -82.66 116.81 22.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.301 0.55 . . . . 0.0 110.195 178.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.623 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 11.1 ttm180 -113.26 126.26 55.21 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.452 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 12.6 t70 -123.89 145.82 48.85 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 156.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.532 ' HG3' ' HD2' ' A' ' 70' ' ' LYS . 4.8 pt-20 -120.63 6.24 10.54 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -162.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.453 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 179.87 29.92 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.917 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 59.7 38.26 21.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.538 0.685 . . . . 0.0 109.456 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.532 ' HD2' ' HG3' ' A' ' 67' ' ' GLU . 96.8 mttt -81.92 -22.85 36.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.074 -173.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 19.66 56.69 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -175.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -100.39 63.59 1.12 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.198 -0.501 . . . . 0.0 110.253 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.8 m95 -70.06 104.35 2.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.679 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.8 mtm180 -134.11 141.1 47.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.407 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.585 ' HB3' HG22 ' A' ' 40' ' ' THR . 79.9 m95 -88.55 125.27 34.7 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 76' ' ' VAL . 6.2 p -70.63 82.62 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-O 122.141 0.972 . . . . 0.0 110.326 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.54 ' HA ' ' ND1' ' A' ' 37' ' ' HIS . 2.1 t70 -172.88 -59.54 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.591 -174.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 163.34 -31.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.888 1.368 . . . . 0.0 107.615 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.466 ' O ' ' HB2' ' A' ' 75' ' ' TRP . 26.3 m -59.98 120.18 48.14 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.925 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 9.5 Cg_exo -75.49 169.18 22.92 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 123.023 2.482 . . . . 0.0 111.287 173.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 61.3 t80 -64.84 125.38 24.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.707 0.289 . . . . 0.0 110.444 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 4.3 m-80 -80.06 110.49 16.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.4 -31.33 17.88 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.694 2.263 . . . . 0.0 112.307 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.7 -11.91 40.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.524 -178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 76.3 mtt180 -127.91 80.39 1.96 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.994 0.426 . . . . 0.0 111.283 -175.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -121.64 98.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -98.94 69.0 1.75 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -65.8 150.03 49.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.953 0.406 . . . . 0.0 111.007 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.506 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 8.7 t-80 -64.79 -51.21 63.43 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.4 pttm 175.79 -159.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -72.43 74.89 1.04 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 168.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.468 ' HG2' ' OD1' ' A' ' 114' ' ' ASN . 4.4 tp10 -91.79 120.25 68.09 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.806 -170.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -72.06 -50.6 0.25 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.745 2.296 . . . . 0.0 111.658 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.4 t70 55.17 -97.4 0.07 Allowed 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.933 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.417 ' H ' ' H ' ' A' ' 96' ' ' SER . 12.3 t-20 175.75 -8.73 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.473 ' HB2' ' O ' ' A' ' 115' ' ' ASP . 28.0 t -41.82 118.95 1.19 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.502 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -164.73 149.42 9.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.808 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.9 -110.29 2.99 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.108 -1.044 . . . . 0.0 110.695 -175.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.672 ' HG2' ' H ' ' A' ' 118' ' ' CYS . 6.3 pm0 -88.74 138.3 31.54 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 174.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.452 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 5.1 p30 -133.23 122.8 24.47 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 110.994 -175.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 73.1 m -130.04 127.26 39.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.465 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.585 ' HA ' ' HA ' ' A' ' 115' ' ' ASP . 30.4 m -81.63 145.67 8.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 0.0 111.59 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.824 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -128.2 155.46 39.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.009 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HG ' HD21 ' A' ' 62' ' ' LEU . 25.9 mt -86.43 105.83 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 171.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.99 141.32 35.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 53.7 t80 -93.09 96.62 10.17 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.021 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.477 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 45.5 t-20 -138.83 140.46 38.51 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.38 27.24 16.89 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 5.5 m-20 62.14 17.06 8.84 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.127 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -121.6 133.37 54.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.383 0.611 . . . . 0.0 111.302 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -79.77 124.98 29.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.071 171.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.506 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -163.56 170.12 17.7 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.595 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -73.65 125.81 28.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.242 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.468 ' OD1' ' HG2' ' A' ' 92' ' ' GLU . 4.2 t30 -124.59 120.25 31.37 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.585 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 10.5 p-10 -89.79 124.85 35.01 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.465 0.65 . . . . 0.0 110.378 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.436 HG13 HD22 ' A' ' 114' ' ' ASN . 30.1 m -129.38 159.4 69.45 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.965 -178.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 96' ' ' SER . 5.5 Cg_endo -49.57 128.55 21.16 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.52 2.147 . . . . 0.0 110.781 172.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.672 ' H ' ' HG2' ' A' ' 99' ' ' GLU . 10.6 m -74.07 -4.09 33.42 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.901 0.382 . . . . 0.0 111.446 -173.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -90.44 0.5 57.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.552 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -82.99 140.97 32.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.87 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.411 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 8.8 mt-10 -93.05 132.2 37.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.105 0.479 . . . . 0.0 111.153 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -152.9 -171.4 3.92 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.343 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 36.2 m -81.2 170.31 16.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 14.2 ptt180 -149.08 159.85 43.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.201 0.524 . . . . 0.0 112.32 -171.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.958 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 39.9 mt -123.55 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.1 t -112.33 130.4 55.96 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -115.63 123.89 49.55 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.655 -176.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.461 HG22 ' HB2' ' A' ' 14' ' ' CYS . 13.8 tt -114.06 135.83 22.14 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 176.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.72 167.02 22.26 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.413 2.075 . . . . 0.0 111.015 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.9 54.1 2.15 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.058 177.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.7 t -88.06 2.22 52.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.055 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.413 ' HB ' HG13 ' A' ' 2' ' ' VAL . 7.3 m -61.9 -26.86 68.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.034 0.445 . . . . 0.0 110.487 177.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.92 -30.07 69.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.301 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -87.5 -14.51 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.203 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.586 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -90.76 22.03 3.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.936 -175.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -64.41 -63.65 1.08 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.166 -0.214 . . . . 0.0 111.426 -176.469 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.55 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 37.7 m-80 -85.18 -23.7 28.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.982 0.42 . . . . 0.0 110.138 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.586 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 2.3 tm? -58.96 -54.88 42.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.928 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.681 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 56.5 t80 -75.58 -20.35 58.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.058 0.456 . . . . 0.0 110.343 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -66.32 -28.33 68.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 0.0 109.851 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -86.95 -31.15 20.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.65 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' SER . . . . . 0.681 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 99.0 p . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.462 -171.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.3 m -140.56 148.7 21.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 p -116.52 123.92 30.03 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 12.6 Cg_exo -70.91 170.5 17.81 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.841 2.36 . . . . 0.0 111.401 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.563 ' H ' HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -61.68 -10.34 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.917 0.389 . . . . 0.0 111.193 176.296 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.37 -35.63 81.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.191 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HD2' ' A' ' 4' ' ' PRO . 16.2 m95 -84.85 142.78 29.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.301 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -85.19 107.34 17.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.801 0.334 . . . . 0.0 110.171 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.39 135.48 39.48 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.86 178.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 78.5 t80 -133.8 110.09 9.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.547 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 67.64 -68.42 0.16 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.041 0.838 . . . . 0.0 110.932 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 p -145.88 -28.24 0.43 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.94 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -86.37 170.95 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.912 0.386 . . . . 0.0 111.15 -174.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.543 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 8.3 m -123.23 132.7 54.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.773 -176.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.472 ' CE1' ' HB2' ' A' ' 127' ' ' LYS . 90.2 m-85 -129.03 129.89 45.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.732 0.301 . . . . 0.0 111.519 -174.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 59.6 t80 -129.5 117.79 18.79 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.891 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -88.58 136.33 3.21 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.293 2.662 . . . . 0.0 112.262 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.58 137.81 52.35 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.8 p -91.05 -4.17 56.58 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.104 0.478 . . . . 0.0 111.061 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.51 ' O ' ' HA ' ' A' ' 123' ' ' SER . 16.3 t70 -77.22 154.01 33.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.935 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.46 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 43.3 m-80 -108.5 140.2 42.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.712 0.291 . . . . 0.0 111.566 -170.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.848 ' HB2' ' HD3' ' A' ' 124' ' ' ARG . 48.8 mmtt -168.22 148.48 4.81 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.231 -177.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.532 HG23 ' OE2' ' A' ' 121' ' ' GLU . 73.2 p -64.47 173.34 2.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.481 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.402 ' HH2' ' HA ' ' A' ' 76' ' ' VAL . 13.2 t90 -60.24 -45.9 91.64 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -61.68 -48.9 78.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.722 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 4.7 mm-40 -60.59 -40.86 93.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.478 179.165 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.621 ' HA ' ' HD2' ' A' ' 124' ' ' ARG . 70.9 m -56.84 -45.58 82.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.307 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -76.91 -21.43 54.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.989 -176.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 34.7 mtm180 -73.08 -43.32 61.98 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.28 0.562 . . . . 0.0 110.149 173.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.49 -35.6 79.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.809 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' SER . 0.1 OUTLIER -85.56 -179.24 6.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.329 174.139 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 57.8 m 75.25 -43.91 0.52 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.784 0.434 . . . . 0.0 112.06 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.95 -21.06 60.79 Favored Glycine 0 C--O 1.227 -0.3 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.032 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.7 ptp -100.16 8.25 43.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.017 0.437 . . . . 0.0 110.636 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.82 29.97 53.32 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.343 -178.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.86 -178.8 4.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.545 0.212 . . . . 0.0 110.918 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.525 ' HB3' HG11 ' A' ' 76' ' ' VAL . 4.7 m-70 -143.12 168.2 20.31 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -57.42 157.45 6.66 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 111.62 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.633 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.6 tpt -52.92 99.4 0.02 OUTLIER 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.505 -176.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.507 ' H ' ' HG2' ' A' ' 127' ' ' LYS . 7.4 p -97.15 90.44 5.14 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.314 170.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.444 HD11 HD11 ' A' ' 104' ' ' LEU . 42.5 mt -55.65 106.08 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.862 -178.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m -70.78 -51.47 26.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.596 -177.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.6 p -130.12 161.38 31.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.38 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.499 ' CD ' HH21 ' A' ' 84' ' ' ARG . 6.1 pt-20 -66.69 -27.94 68.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.986 0.422 . . . . 0.0 110.293 176.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.02 -36.78 84.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.164 174.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.56 -45.71 91.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.168 176.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 51' ' ' ILE . 55.1 tt0 -56.95 -53.88 52.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.05 175.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -58.87 -24.14 61.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.161 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -81.99 -52.08 7.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -66.92 -30.54 49.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.768 0.318 . . . . 0.0 111.619 -172.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.704 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.3 pt -73.16 -1.41 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.996 0.426 . . . . 0.0 111.746 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -83.58 -26.25 30.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.942 175.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -99.13 -23.78 15.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.484 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 83.6 mt -63.95 135.6 56.64 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.504 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -71.47 124.51 24.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.603 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 81.8 mtt180 -79.05 20.21 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -168.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.873 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.7 ptp180 -116.18 -15.71 11.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.721 0.296 . . . . 0.0 110.356 174.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -97.41 172.64 7.63 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.387 0.613 . . . . 0.0 111.439 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -128.28 117.95 22.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.061 176.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.492 ' HB3' HG13 ' A' ' 125' ' ' ILE . 78.2 m-85 -101.59 127.54 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.315 -171.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.662 ' HA ' HG12 ' A' ' 103' ' ' VAL . 1.7 m-85 -62.04 145.01 54.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.154 0.502 . . . . 0.0 112.232 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.667 ' HB2' HG13 ' A' ' 102' ' ' VAL . 95.9 mt -112.61 168.61 9.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.679 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -74.44 3.8 38.56 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 115.18 0.832 . . . . 0.0 115.18 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.913 ' HB2' HG12 ' A' ' 102' ' ' VAL . 4.0 mm? -73.46 117.34 15.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 118.244 1.022 . . . . 0.0 110.903 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -120.23 122.64 41.36 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.331 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 29.9 t70 -141.78 90.69 2.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.852 0.834 . . . . 0.0 109.911 163.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.679 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -74.45 -71.04 0.36 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.621 -177.767 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -84.67 31.61 0.53 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.459 -170.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 49.73 69.93 0.55 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.219 0.533 . . . . 0.0 111.559 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -95.53 -12.79 25.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.12 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.45 -40.35 2.58 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.014 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -81.16 98.04 7.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.073 0.463 . . . . 0.0 110.751 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.596 ' HB3' HD12 ' A' ' 64' ' ' LEU . 58.6 m95 -59.82 128.04 34.93 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.993 175.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -121.09 129.75 53.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.23 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.756 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 55.6 m95 -81.61 108.14 14.94 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.388 178.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 37' ' ' HIS . 48.0 t 45.77 -80.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.706 1.254 . . . . 0.0 114.117 172.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 75' ' ' TRP . 4.3 t70 -96.33 -82.5 0.39 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.919 -168.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -124.44 -19.21 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.756 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 70.1 m -62.69 118.71 44.11 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 120.936 0.398 . . . . 0.0 111.928 -170.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.5 Cg_exo -71.09 169.8 19.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.616 2.877 . . . . 0.0 112.555 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.2 151.24 47.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.345 0.593 . . . . 0.0 110.976 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.644 ' ND2' ' HB2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -119.4 127.08 26.65 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.125 -174.368 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.4 Cg_exo -67.79 -30.3 34.04 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.859 2.373 . . . . 0.0 112.48 175.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.499 HH21 ' CD ' ' A' ' 44' ' ' GLU . 11.2 tpt180 -78.12 -49.81 13.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.564 0.221 . . . . 0.0 111.484 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.644 ' HB2' ' ND2' ' A' ' 82' ' ' ASN . 29.9 mtm180 -80.49 81.25 6.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.069 0.461 . . . . 0.0 110.431 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.501 HG13 ' CD1' ' A' ' 88' ' ' TRP . 95.9 t -138.26 103.75 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.558 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 113' ' ' TRP . 50.7 m-85 -125.93 39.66 3.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.629 ' HB2' ' HE3' ' A' ' 90' ' ' LYS . 66.2 m95 -65.77 160.46 22.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.611 0.243 . . . . 0.0 111.461 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 77.3 m-70 -77.5 -27.77 51.95 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.126 -176.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.629 ' HE3' ' HB2' ' A' ' 88' ' ' TRP . 6.8 mmtp 81.79 -5.59 1.51 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 124.431 1.082 . . . . 0.0 110.14 -176.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.611 ' OD1' ' HB3' ' A' ' 89' ' ' HIS . 2.8 p-10 -113.97 25.77 10.88 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.723 174.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' HB2' ' A' ' 89' ' ' HIS . 1.6 mp0 -57.24 145.82 64.84 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.035 176.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -80.05 -163.14 0.21 Allowed 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.658 2.239 . . . . 0.0 112.093 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.08 114.85 2.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.662 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.515 ' HA ' ' OD2' ' A' ' 115' ' ' ASP . 12.5 m120 -65.9 130.0 41.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.85 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.0 t -78.79 126.16 30.34 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.123 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -0.27 54.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.253 0.549 . . . . 0.0 110.473 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -131.37 105.09 0.61 Allowed Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 175.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 42.3 mt-10 63.2 88.58 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.905 0.383 . . . . 0.0 111.28 -174.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.552 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 6.9 p30 -107.62 118.93 38.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.346 0.593 . . . . 0.0 109.45 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 63.9 m -135.93 144.34 45.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.867 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.913 HG12 ' HB2' ' A' ' 64' ' ' LEU . 12.1 p -100.43 146.74 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 120.987 0.422 . . . . 0.0 111.432 -175.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 61' ' ' PHE . 22.6 m -129.85 156.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.763 175.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.8 mt -88.52 113.4 24.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 171.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -125.8 141.33 45.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.397 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 61.3 t80 -79.92 103.84 10.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.151 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 26.1 t-20 -149.19 135.47 19.21 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.451 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 91.4 mt-30 66.38 31.9 7.97 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -172.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.418 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 12.5 m-20 59.53 26.25 15.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.732 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -145.56 153.1 40.72 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.196 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.704 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 88.0 m95 -87.53 107.05 18.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.853 176.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -129.32 167.31 17.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.944 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.531 ' HB3' HG21 ' A' ' 102' ' ' VAL . 25.2 m0 -74.74 129.16 37.21 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.268 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -127.18 139.63 52.81 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.515 ' OD2' ' HA ' ' A' ' 95' ' ' ASN . 19.1 t70 -89.19 125.24 34.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.737 0.303 . . . . 0.0 111.178 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -143.41 158.05 58.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.513 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 13.4 Cg_endo -58.28 138.11 84.12 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.517 2.145 . . . . 0.0 111.771 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.6 m -70.49 -18.76 62.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.714 0.292 . . . . 0.0 111.029 -178.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -86.1 16.07 4.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.294 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -100.07 126.63 46.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.532 ' OE2' HG23 ' A' ' 23' ' ' THR . 3.2 mm-40 -73.49 124.18 25.33 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.404 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -144.16 176.64 9.17 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.475 177.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 35.0 m -67.55 157.62 33.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.894 0.378 . . . . 0.0 110.7 -177.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.848 ' HD3' ' HB2' ' A' ' 22' ' ' LYS . 80.6 mtm-85 -124.18 153.15 41.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.999 0.428 . . . . 0.0 111.984 -169.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 58.9 mt -134.92 120.72 31.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 171.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 12.5 m -103.49 131.75 50.34 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.507 ' HG2' ' H ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -123.33 135.55 54.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.221 0.534 . . . . 0.0 110.006 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.543 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -128.62 140.17 37.68 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.562 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.77 166.88 3.37 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.617 2.212 . . . . 0.0 111.981 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -71.57 59.19 1.24 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.008 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 77.4 p -71.6 -22.44 61.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.069 0.461 . . . . 0.0 110.349 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.8 m -71.93 -14.57 61.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.061 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 mp -80.06 -32.35 39.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -31.24 20.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.27 41.6 1.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.52 175.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -44.6 79.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.028 -173.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -72.61 -27.21 62.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.316 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.05 -48.3 74.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -71.53 -23.26 61.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.282 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -67.97 -33.09 73.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 0.0 110.243 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -87.93 -6.47 58.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.435 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.103 -175.829 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.499 HG12 ' CG2' ' A' ' 132' ' ' THR . 9.8 p -140.7 142.0 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.801 0.334 . . . . 0.0 110.307 177.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.0 m -139.2 162.37 52.38 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -52.82 142.07 52.99 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.063 1.842 . . . . 0.0 111.131 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.3 mt -73.79 80.47 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -173.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 176.68 -51.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.214 -1.357 . . . . 0.0 108.206 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 17.9 m95 -42.23 123.74 2.57 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.295 177.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -71.74 107.21 4.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 128.31 33.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.235 -176.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 83.8 t80 -139.25 102.11 4.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.644 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 60.67 -89.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.139 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 m -120.27 7.56 10.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.682 0.277 . . . . 0.0 111.282 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -130.35 158.51 39.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.856 0.36 . . . . 0.0 110.99 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 128' ' ' ILE . 74.9 m -131.97 127.52 36.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 79.2 m-85 -115.41 129.06 56.45 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -170.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 33.1 t80 -121.34 114.87 31.6 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 174.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 6.5 Cg_endo -88.48 123.36 1.54 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.326 2.684 . . . . 0.0 112.288 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.461 HD22 ' CZ ' ' A' ' 124' ' ' ARG . 4.7 mp -109.82 139.39 44.95 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 p -105.31 14.98 28.07 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.373 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -85.83 162.29 18.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.0 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 20.0 m120 -85.12 118.24 24.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 1.025 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -149.03 141.73 24.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.772 178.191 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 62.8 p -72.63 174.55 7.39 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 174.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.446 ' CH2' HG23 ' A' ' 76' ' ' VAL . 31.2 t90 -62.42 -39.75 94.29 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.3 68.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.764 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 1.025 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 15.8 mm-40 -61.14 -37.32 82.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.456 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.431 ' HB2' HD21 ' A' ' 38' ' ' LEU . 68.8 m -60.05 -49.29 78.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.715 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.621 ' HG2' HD13 ' A' ' 38' ' ' LEU . 19.6 mm-40 -69.69 -22.02 63.45 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.407 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -67.93 -39.81 83.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.79 0.329 . . . . 0.0 110.918 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.28 -25.98 36.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.333 0.587 . . . . 0.0 109.567 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 88.4 m -85.65 -180.0 6.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.522 172.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 51.7 m 73.34 -44.92 0.6 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.928 0.491 . . . . 0.0 111.66 -178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.63 -22.99 66.59 Favored Glycine 0 C--O 1.227 -0.336 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.758 174.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.5 mtm -96.93 9.53 41.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.33 . . . . 0.0 110.696 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.64 27.75 68.68 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.998 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.85 173.83 10.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.475 0.178 . . . . 0.0 111.028 -175.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -140.2 168.66 19.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.621 HD13 ' HG2' ' A' ' 28' ' ' GLU . 10.8 mp -61.44 149.42 38.63 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.209 0.318 . . . . 0.0 110.37 173.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.4 tpt -50.71 103.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -175.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.515 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 11.8 p -94.45 94.85 8.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.077 172.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.483 HD11 HD11 ' A' ' 104' ' ' LEU . 55.9 mt -66.99 95.8 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.237 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.9 m -92.75 -27.79 17.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.299 0.571 . . . . 0.0 109.811 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 53.0 p -125.2 147.87 48.87 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 122.238 1.018 . . . . 0.0 112.163 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.43 ' OE2' ' HD3' ' A' ' 85' ' ' ARG . 19.9 mt-10 -59.9 -31.45 69.83 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.629 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.446 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.4 -46.04 88.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.582 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.464 ' HB3' ' CE ' ' A' ' 39' ' ' MET . 24.7 mt-10 -49.23 -55.29 13.05 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.583 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.36 -52.69 62.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.001 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -59.25 -34.77 72.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.446 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 59.9 m-85 -88.31 -37.7 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.6 tp -70.21 -30.75 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.283 -174.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.492 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 37.4 pt -71.29 -6.08 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.309 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -87.44 -21.54 25.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.025 176.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -94.81 -23.91 17.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.636 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.6 mt -74.28 139.84 44.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.543 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.421 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -75.36 133.81 41.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 81.5 mtt180 -80.22 16.71 1.19 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -169.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.939 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.9 ptp180 -119.59 -12.31 9.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.719 176.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.939 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -103.11 148.3 25.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.174 0.511 . . . . 0.0 111.607 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 p -100.5 116.91 33.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.541 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB3' HG13 ' A' ' 125' ' ' ILE . 95.4 m-85 -100.77 121.69 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.48 -174.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.838 ' HA ' HG12 ' A' ' 103' ' ' VAL . 14.1 m-85 -58.41 137.42 57.29 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.765 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' A' ' 104' ' ' LEU . 96.4 mt -105.61 157.11 17.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.942 176.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.463 ' O ' ' HE3' ' A' ' 75' ' ' TRP . . . -79.06 61.83 4.07 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.442 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.606 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 21.3 tp -129.64 134.22 47.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -135.33 134.91 40.33 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -170.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -133.61 88.96 2.53 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 164.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -81.84 134.05 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.89 0.376 . . . . 0.0 111.519 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 70.07 18.41 7.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.47 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB2' ' H ' ' A' ' 98' ' ' GLY . . . 62.23 87.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.314 0.578 . . . . 0.0 111.662 177.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.467 ' HE3' ' HB2' ' A' ' 70' ' ' LYS . 21.2 mtmt -112.38 -47.72 3.07 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.414 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.8 -19.3 47.59 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.9 83.85 4.06 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 121.227 0.537 . . . . 0.0 110.033 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.606 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 60.5 m95 -66.23 137.28 56.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.501 -178.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.419 ' O ' HD12 ' A' ' 64' ' ' LEU . 63.7 mtt180 -125.65 166.11 17.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.545 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 96.7 m95 -81.56 176.56 9.56 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.719 -0.793 . . . . 0.0 109.307 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.446 HG23 ' CH2' ' A' ' 24' ' ' TRP . 13.7 p -63.07 -34.4 66.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.854 0.359 . . . . 0.0 111.38 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -107.24 -168.78 1.44 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 177.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -77.6 73.72 4.17 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.42 0.629 . . . . 0.0 110.161 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 8.1 m -131.15 129.22 22.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.222 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 19.3 Cg_exo -68.66 144.91 61.83 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.237 2.625 . . . . 0.0 112.271 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 86' ' ' VAL . 68.3 t80 -69.43 143.43 53.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.17 -176.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 25.3 m-80 -77.55 110.39 12.55 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.704 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.94 -50.37 0.84 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.984 2.456 . . . . 0.0 112.776 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -82.71 -0.88 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 111.507 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 29.8 mtm180 -129.55 62.85 1.53 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.408 HG23 ' HZ ' ' A' ' 81' ' ' PHE . 13.0 p -85.31 -32.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.261 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 66.7 -70.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 174.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.419 ' HB3' ' H ' ' A' ' 89' ' ' HIS . 76.8 m95 53.49 -158.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.746 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.565 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 10.4 t-80 -99.69 -23.8 14.91 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.886 0.374 . . . . 0.0 110.952 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.586 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 21.4 ttpp 171.11 -70.9 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.4 p30 -140.38 11.75 2.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.652 166.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.586 ' OE1' ' HB3' ' A' ' 90' ' ' LYS . 1.7 mp0 -79.36 104.85 2.55 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.155 175.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 88.1 Cg_endo -101.22 -151.9 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 123.72 2.947 . . . . 0.0 113.347 -172.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.8 136.29 58.03 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.315 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -134.67 -37.91 0.82 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.946 0.403 . . . . 0.0 110.965 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.409 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 23.3 t -85.36 152.14 23.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.138 -178.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -126.79 134.13 50.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.815 0.34 . . . . 0.0 110.24 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.498 ' H ' ' HB2' ' A' ' 69' ' ' ALA . . . 91.22 -63.27 2.77 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.531 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 40.8 mt-10 -113.29 74.69 0.88 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.804 0.335 . . . . 0.0 110.114 172.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.409 ' HB3' ' O ' ' A' ' 96' ' ' SER . 1.7 p-10 -106.32 125.19 50.7 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.414 0.626 . . . . 0.0 110.29 177.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 2.2 p -157.66 136.57 11.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.964 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 30.1 m -88.67 147.7 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.408 0.623 . . . . 0.0 112.155 -173.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.838 HG12 ' HA ' ' A' ' 61' ' ' PHE . 25.2 m -124.5 158.62 31.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.14 174.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.7 mt -84.0 115.64 22.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.5 p -125.87 141.49 45.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.688 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 63.4 t80 -91.19 97.5 11.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.4 176.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.413 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 47.7 t-20 -141.38 132.93 26.97 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 66.18 31.85 8.42 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 123.838 0.712 . . . . 0.0 109.32 -171.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 15.2 m-20 60.09 25.06 14.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 114.55 -1.205 . . . . 0.0 112.414 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.542 ' HZ2' ' HB2' ' A' ' 90' ' ' LYS . 59.3 pttt -132.97 141.58 48.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 0.0 111.018 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.492 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 83.2 m95 -88.37 110.77 21.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.762 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.565 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -148.47 170.84 17.14 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.089 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -73.91 134.29 43.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.757 -175.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -134.01 123.93 25.4 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.08 131.68 38.5 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 19.4 m -140.75 158.89 64.46 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.337 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.526 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 16.2 Cg_endo -59.22 128.69 28.45 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.302 2.001 . . . . 0.0 111.138 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.556 ' O ' ' HB ' ' A' ' 23' ' ' THR . 83.6 m -65.84 -17.34 64.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -177.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -82.49 -2.29 52.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.771 0.319 . . . . 0.0 111.263 177.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -83.7 115.45 22.19 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 1.4 mt-10 -72.34 110.64 6.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.452 0.644 . . . . 0.0 110.671 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -130.44 -172.05 2.7 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.511 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 33.1 m -78.25 169.57 18.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.461 ' CZ ' HD22 ' A' ' 18' ' ' LEU . 11.9 ptt180 -151.04 150.24 30.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.098 0.475 . . . . 0.0 111.91 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.642 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.1 mt -115.24 121.37 67.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.94 121.46 44.82 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.515 ' HD3' ' H ' ' A' ' 40' ' ' THR . 22.3 ptmt -115.41 127.36 55.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.985 0.422 . . . . 0.0 111.048 -176.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.549 HG22 ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -103.98 134.18 19.85 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.24 167.47 25.79 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.076 1.85 . . . . 0.0 110.938 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -68.26 60.86 0.41 Allowed Glycine 0 CA--C 1.521 0.442 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.131 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -76.63 10.37 2.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.198 0.523 . . . . 0.0 111.304 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.499 ' CG2' HG12 ' A' ' 2' ' ' VAL . 1.9 m -67.28 -18.58 65.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.583 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.03 -34.48 66.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.182 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -77.42 -38.3 49.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 0.0 109.337 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -85.46 31.22 0.59 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.981 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 12.3 pt-20 -60.12 -35.21 74.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.715 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.411 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 76.8 m-20 -73.31 -28.64 62.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.548 -177.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -68.17 -20.34 64.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.46 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -71.71 -38.58 70.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -73.91 -40.27 63.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.241 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 44.4 m . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.57 -179.269 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.696 HG13 HG21 ' A' ' 132' ' ' THR . 2.4 p -69.45 120.05 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.54 0.686 . . . . 0.0 110.877 -179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.641 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 71.3 m -144.72 -178.36 0.78 Allowed Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.07 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.641 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 95.1 Cg_exo -46.98 147.68 4.74 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 121.818 1.679 . . . . 0.0 111.851 170.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tp -59.38 146.86 8.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.945 -172.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 77.81 -33.79 0.18 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.51 1.124 . . . . 0.0 112.023 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 24.1 m95 -47.73 118.6 2.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.817 0.341 . . . . 0.0 110.124 175.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.3 mmt-85 -71.47 113.45 8.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.481 -172.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.52 124.13 31.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.774 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.457 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 33.0 t80 -121.44 104.33 9.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 58.89 -101.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.435 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 t -96.91 -36.16 10.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.346 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -80.42 169.12 18.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.562 -173.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.96 136.33 26.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.366 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 24.9 m-85 -121.71 131.86 54.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.251 -169.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -111.67 115.26 51.55 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.198 176.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -89.09 124.85 1.5 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 123.107 2.538 . . . . 0.0 111.574 174.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -138.01 143.9 40.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.402 0.62 . . . . 0.0 111.272 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 73.9 p -110.27 18.77 19.56 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.798 -170.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -78.58 130.51 36.02 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.423 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.621 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 4.8 m-20 -63.48 100.52 0.26 Allowed 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.921 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.621 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 14.8 mmmm -133.63 143.75 48.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.626 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.4 p -65.79 163.85 15.9 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 174.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 60.0 t90 -57.76 -39.35 77.2 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.12 -51.67 68.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.892 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HA ' ' HB2' ' A' ' 29' ' ' ARG . 14.5 mm-40 -70.57 -26.92 63.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.239 -177.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 53.1 m -58.0 -50.39 73.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.763 0.316 . . . . 0.0 110.33 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -70.81 -25.89 63.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.658 178.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -71.1 -51.43 25.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.938 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.431 ' HB3' HH12 ' A' ' 124' ' ' ARG . 3.7 t-20 -74.94 -30.67 61.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.1 0.476 . . . . 0.0 110.579 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.5 m -84.51 179.42 7.41 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.2 m 80.04 -45.11 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.532 0.733 . . . . 0.0 109.966 -174.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.67 -25.7 70.53 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.669 171.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.652 ' HG3' ' H ' ' A' ' 36' ' ' ALA . 21.7 ptp -88.7 1.79 54.49 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 110.573 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.44 -13.11 59.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.217 -176.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.652 ' H ' ' HG3' ' A' ' 34' ' ' MET . . . -95.43 141.13 29.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.89 -0.182 . . . . 0.0 110.512 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.543 ' CD2' HG13 ' A' ' 76' ' ' VAL . 13.5 t60 -118.97 158.14 26.34 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.446 ' HB2' HG21 ' A' ' 76' ' ' VAL . 5.9 mp -51.71 139.03 22.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -174.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.655 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.0 tpt -40.02 98.68 0.01 OUTLIER 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.436 -1.256 . . . . 0.0 113.448 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.56 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 6.4 p -94.79 91.84 6.67 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.453 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 59.9 mt -59.4 100.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.279 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -85.64 -34.4 21.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.032 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 35.1 p -130.23 151.61 50.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.379 0.609 . . . . 0.0 111.374 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -65.86 -35.51 80.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.851 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.3 -41.51 98.57 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 120.914 0.387 . . . . 0.0 110.357 175.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.568 ' HB3' ' O ' ' A' ' 43' ' ' THR . 66.4 tt0 -52.34 -51.76 57.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.611 175.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -46.05 90.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.66 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -62.39 -28.36 69.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.116 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.555 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 15.9 m-85 -85.32 -31.87 22.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.8 tp -78.36 -32.69 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.029 -0.668 . . . . 0.0 111.384 -176.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.2 pt -65.28 -20.47 27.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.5 pt20 -87.79 -11.36 48.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.097 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -92.48 -26.34 18.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.049 0.452 . . . . 0.0 110.03 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 68.0 mt -77.05 159.94 29.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.982 -176.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.404 ' OD2' HD13 ' A' ' 58' ' ' LEU . 4.2 t70 -70.61 137.75 50.23 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.826 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -90.23 38.82 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.168 0.509 . . . . 0.0 111.698 -171.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -142.15 -46.83 0.35 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.53 172.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.404 HD13 ' OD2' ' A' ' 55' ' ' ASP . 0.2 OUTLIER -61.67 163.49 7.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.797 0.808 . . . . 0.0 112.737 -171.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.875 ' HB3' HG11 ' A' ' 103' ' ' VAL . 1.4 m -108.17 129.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.94 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.516 ' N ' HG22 ' A' ' 103' ' ' VAL . 97.4 m-85 -117.38 120.15 37.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.517 0.198 . . . . 0.0 111.425 -175.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.94 130.15 42.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.084 0.468 . . . . 0.0 111.175 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 104' ' ' LEU . 80.1 mt -111.63 175.93 5.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.337 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.73 39.44 2.71 Favored Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.69 -175.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.717 ' HB2' HG22 ' A' ' 102' ' ' VAL . 3.5 mm? -100.18 114.32 27.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 65' ' ' ARG . 7.9 ttt85 -120.41 114.8 22.35 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -168.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -127.97 105.68 8.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 166.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -46.81 -78.24 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.902 -1.045 . . . . 0.0 113.265 -175.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -127.8 48.06 2.31 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.269 -170.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.35 70.87 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.595 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -87.57 -15.53 37.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.818 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.83 -45.41 3.47 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -175.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.21 92.13 6.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.692 0.758 . . . . 0.0 110.086 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -69.69 160.83 30.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.375 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 16.5 ptt180 -154.1 171.8 18.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.298 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -84.06 -176.18 6.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.976 0.417 . . . . 0.0 110.197 174.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.543 HG13 ' CD2' ' A' ' 37' ' ' HIS . 13.3 p -82.29 1.29 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.215 0.531 . . . . 0.0 111.486 -171.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.506 ' OD2' HG21 ' A' ' 40' ' ' THR . 1.6 p30 -123.89 -104.74 0.36 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.089 176.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -121.16 -23.59 5.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.466 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.1 m -54.46 123.02 41.6 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.634 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 27.3 Cg_exo -65.18 149.06 89.26 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.135 2.556 . . . . 0.0 111.988 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.82 136.92 57.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.838 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -87.81 112.15 47.01 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.88 7.4 4.63 Favored 'Trans proline' 0 CA--C 1.53 0.296 0 C-N-CA 122.646 2.231 . . . . 0.0 113.705 -174.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -119.27 -27.12 5.71 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.418 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -106.83 34.46 3.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.408 ' O ' HG13 ' A' ' 86' ' ' VAL . 6.2 p -80.42 95.76 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.846 0.832 . . . . 0.0 109.811 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -81.71 72.82 8.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.381 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -69.78 152.39 44.66 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.571 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 11.6 t-80 -66.07 -42.53 89.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.901 -171.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -177.82 -59.8 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.33 0.586 . . . . 0.0 109.98 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.54 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 1.0 OUTLIER -135.08 0.1 2.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.808 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -95.05 105.48 19.64 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.474 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 86.6 Cg_endo -95.82 -154.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 123.369 2.713 . . . . 0.0 111.512 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.96 146.36 33.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.56 -34.66 0.24 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.855 -171.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.584 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 67.2 m -65.27 97.89 0.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 111.583 -176.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -74.16 83.65 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.82 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.04 97.87 1.01 Allowed Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -174.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.606 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 33.1 mt-10 59.9 74.81 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.128 0.49 . . . . 0.0 110.858 -171.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.584 ' HB3' ' O ' ' A' ' 96' ' ' SER . 6.0 p-10 -100.58 101.75 12.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.573 0.701 . . . . 0.0 110.556 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 67.5 m -117.66 156.27 28.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.831 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.722 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 23.0 m -103.25 155.79 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.255 0.55 . . . . 0.0 110.819 177.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.875 HG11 ' HB3' ' A' ' 59' ' ' SER . 0.4 OUTLIER -123.03 143.98 34.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.533 176.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 62' ' ' LEU . 17.8 tp -85.49 103.54 14.46 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 171.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.635 HG11 HD21 ' A' ' 114' ' ' ASN . 10.0 p -128.33 139.2 52.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.176 0.512 . . . . 0.0 111.785 -172.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.569 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 11.6 t80 -88.37 104.49 16.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -146.71 142.02 27.39 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 39.6 mt-30 53.46 65.69 1.45 Allowed 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.638 0.586 . . . . 0.0 110.342 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.1 p30 58.76 4.35 0.38 Allowed 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 173.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' A' ' 108' ' ' GLN . 9.4 pttm -155.56 153.56 30.35 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.569 ' NE1' ' HD2' ' A' ' 106' ' ' TYR . 81.0 m95 -84.07 140.54 31.76 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.019 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.571 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -179.27 -179.4 0.55 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.65 0.594 . . . . 0.0 109.907 173.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.722 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 39.4 m0 -88.48 139.33 30.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.728 0.299 . . . . 0.0 111.03 -177.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.635 HD21 HG11 ' A' ' 105' ' ' VAL . 26.0 p30 -123.41 162.19 23.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.04 171.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.35 124.69 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.254 0.346 . . . . 0.0 110.928 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -147.77 141.89 16.1 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.204 175.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.606 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 10.0 Cg_endo -55.86 136.02 72.49 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.476 2.117 . . . . 0.0 111.395 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.439 ' HB2' ' OE1' ' A' ' 99' ' ' GLU . 15.0 m -67.15 -17.43 64.85 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.883 0.373 . . . . 0.0 110.665 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.32 7.27 33.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.8 t80 -88.98 143.76 26.63 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.75 135.7 35.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.873 0.368 . . . . 0.0 110.947 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.3 -168.8 1.96 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.543 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.403 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 20.2 m -78.59 169.44 18.24 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.475 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 13.0 ptt180 -147.25 162.91 37.95 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -172.274 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.655 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 8.3 mm -126.19 123.63 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.249 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 93.0 m -123.21 127.65 48.91 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.996 0.427 . . . . 0.0 110.293 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HD3' ' H ' ' A' ' 40' ' ' THR . 21.6 ptmt -116.29 140.14 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.871 -175.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 16.0 tt -125.96 145.29 51.49 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.211 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.06 167.33 14.43 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.514 2.143 . . . . 0.0 111.444 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.32 74.46 0.54 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.757 175.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 25.8 p -83.19 19.51 1.45 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.506 0.323 . . . . 0.0 111.864 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.696 HG21 HG13 ' A' ' 2' ' ' VAL . 14.5 t -60.15 -24.94 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.451 -178.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.6 mt -82.1 -23.83 35.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -89.47 -49.51 6.65 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.341 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.52 33.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.67 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.641 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -59.76 -64.21 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -175.706 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.641 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 6.2 p30 -84.3 -20.29 32.36 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.66 -45.52 89.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.566 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -72.69 -21.56 61.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.38 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -73.31 -23.42 60.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.357 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 73.5 mt-30 -86.07 -6.8 58.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 177.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.01 -177.206 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.812 ' HG3' ' HA3' ' A' ' 130' ' ' GLY . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -164.53 131.91 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.923 0.392 . . . . 0.0 110.076 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.1 m -141.09 166.56 21.7 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -177.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 66.8 Cg_exo -51.9 154.67 9.56 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.567 2.178 . . . . 0.0 112.489 176.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.8 tp -70.2 -14.88 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.817 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.59 -31.74 68.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.987 176.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 24.1 m95 -86.5 160.67 18.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.704 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 48.3 mmt-85 -111.8 122.89 49.02 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.112 177.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.37 124.29 42.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.121 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.468 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 82.9 t80 -121.8 103.27 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.837 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 65.6 -73.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.1 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.585 ' HA ' ' HG2' ' A' ' 1' ' ' MET . 18.3 m -139.32 5.38 2.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -123.95 157.88 33.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.788 0.327 . . . . 0.0 111.003 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.8 m -122.87 128.0 49.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.681 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 3.7 m-85 -119.35 138.15 53.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.18 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.425 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 62.1 t80 -139.23 115.68 8.51 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -88.01 138.11 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.839 2.36 . . . . 0.0 112.293 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.8 mp -124.43 139.6 53.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.974 0.416 . . . . 0.0 110.143 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.5 p -110.31 35.19 3.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.871 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.86 -27.23 40.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.3 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.519 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 46.6 m-80 70.08 116.19 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.62 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 13.3 mmmm -159.37 150.44 19.83 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.672 HG23 ' OE2' ' A' ' 121' ' ' GLU . 16.6 p -60.38 166.8 2.83 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 170.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.463 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 63.3 t90 -59.32 -42.26 90.98 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.511 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.41 -51.34 69.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.74 176.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.636 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 32.4 mm-40 -68.14 -31.22 70.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.467 ' HB3' HD21 ' A' ' 38' ' ' LEU . 54.2 m -65.27 -40.74 94.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.822 0.344 . . . . 0.0 110.236 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -71.31 -34.02 70.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.761 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 98.0 mtt180 -69.68 -40.15 76.54 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.845 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -76.16 -25.82 55.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.39 0.614 . . . . 0.0 109.769 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 32' ' ' SER . 67.0 m -85.68 -179.45 6.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 167.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 29.1 m 79.46 -43.68 0.3 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.064 0.546 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.88 -25.18 67.48 Favored Glycine 0 C--O 1.227 -0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.807 173.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 71.5 mtm -94.61 7.1 46.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.871 0.367 . . . . 0.0 110.392 177.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.6 -6.68 64.26 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.152 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.56 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.39 162.83 13.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.522 0.201 . . . . 0.0 110.69 -177.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -133.4 168.57 18.37 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 27' ' ' SER . 76.1 mt -61.39 146.28 48.8 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.931 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.6 tpt -44.88 110.79 0.25 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.161 0.913 . . . . 0.0 113.178 -172.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB3' ' A' ' 75' ' ' TRP . 23.7 p -101.8 105.76 16.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.892 173.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.545 HD11 HD11 ' A' ' 104' ' ' LEU . 45.4 mt -79.2 119.42 28.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.091 0.472 . . . . 0.0 110.538 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.5 p -106.58 -36.62 6.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.261 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 70.5 p -127.71 152.97 47.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 112.032 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.93 -33.05 74.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.53 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -68.29 -44.45 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.622 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -52.54 -48.71 65.94 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.885 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -59.96 -48.94 79.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.978 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -62.19 -23.09 66.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.238 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.429 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 30.5 m-85 -88.33 -39.07 14.64 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 177.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.552 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -71.4 -30.49 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.305 -176.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.1 pt -71.62 -3.96 4.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.85 0.357 . . . . 0.0 111.312 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -87.25 -21.74 25.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.852 175.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 -19.77 18.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.151 178.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 79.1 mt -79.06 134.05 36.77 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.966 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.25 128.29 35.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.964 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.1 mtt180 -72.39 53.78 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -160.33 -29.95 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.317 177.592 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.702 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -86.9 158.39 19.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.29 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.7 m -109.47 118.89 37.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.527 176.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.754 ' HB3' HG13 ' A' ' 125' ' ' ILE . 91.4 m-85 -105.23 120.91 42.71 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.757 0.281 . . . . 0.0 111.757 -173.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.748 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.8 m-85 -58.6 137.87 57.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.104 0.478 . . . . 0.0 112.048 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.668 HD21 ' HG ' ' A' ' 104' ' ' LEU . 91.1 mt -103.8 166.02 10.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.707 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -87.07 34.74 3.53 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.898 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.6 tp -92.11 114.74 27.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 21.7 ttm-85 -104.19 126.99 51.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -168.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.481 ' O ' ' HA ' ' A' ' 99' ' ' GLU . 16.2 t70 -142.24 101.05 3.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.896 168.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.514 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 0.4 OUTLIER -102.18 137.08 40.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.68 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.67 7.17 6.12 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.011 177.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 1.014 ' HB2' ' HA2' ' A' ' 98' ' ' GLY . . . 69.07 95.94 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.297 0.57 . . . . 0.0 111.448 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' CB ' ' HG2' ' A' ' 72' ' ' GLN . 92.5 mttt -118.68 -35.73 3.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.78 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.62 -4.28 79.27 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.757 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.41 ' HG2' ' CB ' ' A' ' 70' ' ' LYS . 8.2 pt20 -93.11 100.91 13.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.391 0.615 . . . . 0.0 110.363 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -71.73 112.09 7.54 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.151 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -135.71 141.77 44.95 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 93.9 m95 -78.86 156.92 28.46 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.891 176.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 p -56.9 -45.18 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.36 -174.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -94.03 -158.06 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -81.83 67.8 7.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.187 0.517 . . . . 0.0 110.118 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 13.1 m -130.29 113.05 16.96 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-O 121.305 0.574 . . . . 0.0 110.099 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -69.04 154.43 70.59 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.443 2.762 . . . . 0.0 112.025 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.496 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 85.0 t80 -78.16 133.06 37.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 27.9 m-80 -102.33 104.22 35.94 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.766 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -64.79 -33.62 52.93 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.838 2.359 . . . . 0.0 112.289 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -80.07 -18.31 50.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.057 0.456 . . . . 0.0 110.738 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 82.8 mtt180 -119.28 37.66 4.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.092 0.472 . . . . 0.0 110.995 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.525 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.8 p -93.56 127.93 45.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.432 174.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -110.37 72.14 0.78 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.929 0.395 . . . . 0.0 111.117 -173.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -71.4 174.8 6.07 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.428 0.632 . . . . 0.0 111.423 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.595 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 24.9 m-70 -88.0 -168.51 2.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 171.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -126.26 -23.56 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.602 -0.439 . . . . 0.0 112.015 -174.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -135.68 6.21 3.19 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.595 ' OE1' ' HB3' ' A' ' 89' ' ' HIS . 4.6 mp0 -118.21 98.75 51.62 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.983 -173.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -97.96 -164.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.558 2.839 . . . . 0.0 113.396 -176.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.431 ' HA ' ' HB2' ' A' ' 115' ' ' ASP . 2.7 m-20 -49.06 130.69 18.91 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.78 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -107.35 3.49 25.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.749 173.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.649 ' HB2' ' HD3' ' A' ' 117' ' ' PRO . 34.3 t -165.52 149.45 8.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -121.91 83.07 2.04 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 1.014 ' HA2' ' HB2' ' A' ' 69' ' ' ALA . . . 144.2 114.53 0.96 Allowed Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.395 -173.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' A' ' 66' ' ' ASP . 43.7 mt-10 54.55 67.12 1.06 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.21 0.528 . . . . 0.0 109.636 -171.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -102.61 109.0 20.48 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.286 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.2 p -123.24 137.53 54.85 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.968 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.63 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 32.0 m -86.55 148.59 4.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.345 0.593 . . . . 0.0 111.71 -175.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.748 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.4 m -122.06 153.66 26.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.401 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD21 ' A' ' 62' ' ' LEU . 19.1 mt -83.52 106.45 15.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.488 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 7.3 p -125.79 146.2 31.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.442 -177.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.605 ' CE1' ' HA ' ' A' ' 109' ' ' ASP . 86.2 t80 -87.93 109.08 19.53 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.79 -177.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.53 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 19.0 m120 -140.77 127.01 19.71 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 63.21 37.85 10.93 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.42 0.629 . . . . 0.0 109.896 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.605 ' HA ' ' CE1' ' A' ' 106' ' ' TYR . 9.3 t70 73.68 -17.47 0.44 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.117 -1.402 . . . . 0.0 111.959 178.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 112' ' ' ALA . 6.2 pttp -102.22 142.09 34.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.494 0.664 . . . . 0.0 111.029 -175.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -84.35 135.6 34.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.421 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -157.12 165.93 34.65 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.228 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.63 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 20.3 m0 -76.52 123.77 26.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.446 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.488 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 4.6 t30 -111.74 123.62 50.63 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.431 ' HB2' ' HA ' ' A' ' 94' ' ' ASP . 5.2 m-20 -67.71 123.29 20.09 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.515 0.509 . . . . 0.0 109.871 177.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.474 ' CG2' ' HD2' ' A' ' 117' ' ' PRO . 4.1 p -144.47 146.56 33.13 Favored Pre-proline 0 C--N 1.32 -0.709 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.649 ' HD3' ' HB2' ' A' ' 96' ' ' SER . 11.6 Cg_endo -57.12 133.29 56.73 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.932 1.754 . . . . 0.0 111.324 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 85.0 m -64.39 -9.36 17.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -96.68 22.64 7.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.03 0.443 . . . . 0.0 110.719 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' THR . 74.1 t80 -99.76 128.04 45.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.698 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.672 ' OE2' HG23 ' A' ' 23' ' ' THR . 45.1 mm-40 -73.67 123.22 23.65 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.519 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -152.05 178.99 8.87 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.1 m -72.96 168.77 18.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -148.19 150.27 33.45 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.998 0.428 . . . . 0.0 112.003 -170.71 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.754 HG13 ' HB3' ' A' ' 60' ' ' TYR . 54.6 mt -116.91 125.15 73.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.271 173.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.7 t -103.25 126.61 50.5 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -128.9 127.23 41.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.768 -171.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.56 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.8 tt -132.15 141.97 43.34 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.58 157.26 62.6 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 121.942 1.761 . . . . 0.0 110.864 171.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.812 ' HA3' ' HG3' ' A' ' 1' ' ' MET . . . -75.36 58.03 2.85 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.215 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.3 t -87.03 19.31 3.12 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.125 0.57 . . . . 0.0 110.914 -174.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -28.79 58.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.266 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.5 mt -70.18 -31.7 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.491 . . . . 0.0 110.619 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.01 -39.74 14.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.307 0.575 . . . . 0.0 110.121 177.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.83 38.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.728 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.2 -46.86 79.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.729 0.3 . . . . 0.0 111.576 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.574 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 57.1 t30 -75.22 -30.01 60.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.454 -177.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.546 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 6.9 tt -64.64 -48.19 75.74 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -70.26 -20.66 63.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.274 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -75.2 -32.25 61.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.508 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 78.3 mm-40 -87.39 -6.4 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.93 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.998 -176.434 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtt . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.8 m -113.8 170.57 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 169.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' A' ' 7' ' ' TRP . 6.0 p -119.65 116.01 33.46 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-O 121.099 0.476 . . . . 0.0 111.209 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 3' ' ' CYS . 44.3 Cg_endo -68.4 171.13 13.43 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.135 2.557 . . . . 0.0 111.292 174.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 35.7 mt -70.44 70.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.539 0.685 . . . . 0.0 111.184 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -166.96 -42.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.629 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 37.3 m95 -62.41 119.31 8.86 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 164.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -72.43 109.22 5.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.915 0.388 . . . . 0.0 110.783 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.99 121.48 25.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.251 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.612 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 85.5 t80 -139.15 129.87 26.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.447 ' HG3' ' CD2' ' A' ' 10' ' ' PHE . 52.0 mt-30 66.03 -82.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.697 0.623 . . . . 0.0 110.345 -175.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -152.19 8.64 0.48 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.742 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.439 ' OD1' ' HA ' ' A' ' 129' ' ' PRO . 60.5 m-80 -116.98 166.64 11.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.405 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.745 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 4.1 m -118.03 127.49 53.86 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.612 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 35.7 m-85 -122.52 133.13 54.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.497 0.189 . . . . 0.0 111.034 -174.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 52.5 t80 -140.34 117.35 8.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.857 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.1 Cg_endo -84.22 137.43 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.376 2.717 . . . . 0.0 112.105 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.472 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mp -129.44 140.01 51.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.1 p -101.65 21.94 13.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.947 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.52 149.18 50.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.498 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -83.27 97.67 9.0 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 170.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -143.79 145.91 32.71 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.068 0.461 . . . . 0.0 111.065 -172.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.0 p -80.78 173.78 12.27 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.708 173.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 9.6 t90 -65.25 -35.91 82.48 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -64.0 -48.9 74.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.832 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -62.93 -44.11 96.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.246 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.408 ' HB2' HD11 ' A' ' 38' ' ' LEU . 10.9 p -65.13 -33.1 75.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.647 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' HD21 ' A' ' 38' ' ' LEU . 27.2 tt0 -61.57 -37.82 85.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 174.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 15.6 mmm180 -84.49 -36.81 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.403 -176.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -74.0 -37.92 64.26 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.122 0.487 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.5 m -84.81 177.23 8.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 169.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.744 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 18.8 m 75.77 -48.48 0.6 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.497 0.319 . . . . 0.0 110.594 -175.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.88 -30.68 73.65 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 121.288 -0.482 . . . . 0.0 112.229 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 77.7 mtm -80.32 4.16 18.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.984 0.421 . . . . 0.0 110.788 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.72 51.76 7.76 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.744 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -147.02 -175.49 4.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.086 -0.557 . . . . 0.0 109.91 -173.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -149.29 170.43 18.53 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 175.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 28' ' ' GLU . 4.2 mm? -63.59 157.6 23.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.842 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -61.55 96.41 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.394 0.616 . . . . 0.0 111.586 -177.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.35 98.34 8.72 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.466 176.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.408 HD11 HD11 ' A' ' 104' ' ' LEU . 52.8 mt -64.6 115.51 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.669 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 -28.13 16.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.103 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 25.5 p -141.38 154.91 45.91 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.532 0.682 . . . . 0.0 111.652 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.41 -37.49 83.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.204 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.401 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -59.82 -41.44 91.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.115 0.484 . . . . 0.0 109.999 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' O ' ' A' ' 43' ' ' THR . 70.3 tt0 -51.5 -51.99 50.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.593 174.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HA ' HG22 ' A' ' 50' ' ' ILE . 53.0 tt0 -58.08 -50.4 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.068 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -56.8 -30.85 64.1 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.234 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.401 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 36.6 m-85 -88.53 -39.31 14.25 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.07 -28.56 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.377 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.49 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.9 pt -70.3 -8.8 11.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.963 0.411 . . . . 0.0 111.403 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -87.68 -18.21 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.308 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -93.03 -20.25 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.068 176.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 82.3 mt -81.84 130.27 35.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.994 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.3 t70 -64.5 136.61 57.23 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 172.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.471 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 84.9 mtt180 -86.99 15.97 5.44 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -169.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.637 ' HG2' HD22 ' A' ' 58' ' ' LEU . 9.8 ptp85 -113.62 -11.99 12.92 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.304 -0.559 . . . . 0.0 111.083 174.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.637 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.3 mm? -99.24 164.56 12.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.284 0.564 . . . . 0.0 111.717 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -120.63 114.4 21.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.254 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 125' ' ' ILE . 47.7 m-85 -102.51 126.62 49.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.587 0.218 . . . . 0.0 111.587 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.785 ' HA ' HG12 ' A' ' 103' ' ' VAL . 33.2 m-85 -62.14 139.87 58.45 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.962 0.41 . . . . 0.0 111.707 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.475 HD21 ' HG ' ' A' ' 104' ' ' LEU . 73.5 mt -105.02 158.56 16.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.145 175.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.4 ' CA ' ' HB3' ' A' ' 38' ' ' LEU . . . -83.2 53.89 4.91 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 114.461 0.544 . . . . 0.0 114.461 -170.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.664 HD21 HG22 ' A' ' 102' ' ' VAL . 2.3 pt? -135.36 150.24 49.89 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -153.35 144.32 22.87 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.433 0.635 . . . . 0.0 111.401 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.825 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 30.7 t70 -107.98 93.57 4.61 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 162.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 3.4 tm-20 -64.97 112.74 3.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.87 -167.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 52.99 34.8 17.77 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.642 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.41 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 66.79 92.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.617 0.723 . . . . 0.0 112.046 175.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 41.3 mttp -126.13 -13.52 6.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 177.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.01 19.73 79.78 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.099 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.79 93.74 4.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.477 0.656 . . . . 0.0 110.706 -178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -71.8 103.24 3.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.541 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -147.92 155.62 41.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.821 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.618 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 80.0 m95 -81.93 168.6 17.73 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 176.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.09 -34.22 67.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -116.09 79.23 1.28 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 70.79 -50.0 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.066 173.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 18.7 m -47.41 124.1 9.07 Favored Pre-proline 0 C--N 1.329 -0.322 0 C-N-CA 123.361 0.665 . . . . 0.0 112.548 -170.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.4 Cg_exo -71.63 153.55 59.8 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 123.168 2.579 . . . . 0.0 111.625 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.51 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 87.4 t80 -61.52 147.06 46.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.366 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.496 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 50.6 m-80 -98.8 100.04 8.9 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.844 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 74.0 Cg_endo -79.65 -24.95 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.355 2.037 . . . . 0.0 112.011 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -91.16 -7.79 50.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.134 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 78.4 mtm180 -134.59 44.97 2.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.12 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 p -95.28 131.55 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.143 0.497 . . . . 0.0 109.839 177.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -115.65 74.5 0.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -175.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -75.12 -179.52 4.42 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 90.9 m-70 -89.97 -70.41 0.67 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.405 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.608 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 1.6 tmtm? 166.96 -30.12 0.0 OUTLIER 'General case' 0 C--O 1.235 0.32 0 O-C-N 124.037 0.835 . . . . 0.0 110.028 -177.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.608 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 2.4 t30 -144.04 61.45 1.36 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.26 -174.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.464 ' OE2' ' HB2' ' A' ' 89' ' ' HIS . 3.0 mm-40 -63.9 144.5 98.06 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.759 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.22 -65.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.007 2.471 . . . . 0.0 113.032 -176.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -163.49 159.66 22.34 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.38 103.84 14.66 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 176.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.9 m -51.06 108.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.566 0.698 . . . . 0.0 111.893 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.553 ' H ' ' CD ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -79.74 19.82 0.64 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.395 -178.305 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -162.08 111.19 0.47 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.711 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 5.9 mm-40 55.75 83.93 0.09 Allowed 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.423 0.63 . . . . 0.0 110.848 -171.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.825 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 3.1 t-20 -101.09 124.79 47.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.205 -171.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.7 p -157.0 166.1 34.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.273 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.664 HG22 HD21 ' A' ' 64' ' ' LEU . 1.3 m -115.96 153.86 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.888 -176.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 ' HA ' ' A' ' 61' ' ' PHE . 23.1 m -124.88 153.47 31.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.132 177.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.475 ' HG ' HD21 ' A' ' 62' ' ' LEU . 23.4 mt -84.55 109.67 18.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 171.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.0 143.24 41.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.562 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -84.25 102.42 12.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.446 177.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 19.3 t-20 -147.47 136.73 22.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.668 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.477 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 25.3 mt-30 69.94 31.81 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.994 0.808 . . . . 0.0 109.092 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 t0 63.52 22.11 13.05 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.362 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.61 152.76 40.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.66 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.49 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -77.54 138.4 39.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.547 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -166.99 165.62 15.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.621 0.248 . . . . 0.0 110.95 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -77.74 135.31 38.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.55 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -125.36 135.85 52.85 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -73.31 124.7 26.22 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 123.388 0.43 . . . . 0.0 110.393 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 17.1 m -143.52 156.42 60.17 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.893 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -67.5 132.18 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.237 1.958 . . . . 0.0 110.907 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.711 ' HB2' ' HB3' ' A' ' 99' ' ' GLU . 81.9 m -62.37 -21.56 65.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.932 0.396 . . . . 0.0 111.309 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -94.93 64.37 2.83 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.496 0.665 . . . . 0.0 110.099 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -140.65 139.91 34.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.21 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -78.3 110.83 13.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.143 0.497 . . . . 0.0 111.22 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.487 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -147.76 179.09 7.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.457 175.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 p -80.54 174.59 11.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.784 0.326 . . . . 0.0 110.402 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.472 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 19.1 ptt180 -144.96 156.35 43.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.039 0.447 . . . . 0.0 111.564 -171.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.842 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 30.6 mt -122.41 131.62 72.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.04 124.22 48.1 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 19.7 tptm -112.28 111.75 22.85 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.504 -172.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.745 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 38.1 mt -96.85 124.35 50.41 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.553 174.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.439 ' HA ' ' OD1' ' A' ' 13' ' ' ASN . 40.3 Cg_endo -69.07 168.74 19.78 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.673 2.249 . . . . 0.0 111.279 177.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.59 37.69 0.1 OUTLIER Glycine 0 CA--C 1.526 0.754 0 N-CA-C 114.497 0.559 . . . . 0.0 114.497 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 129' ' ' PRO . 7.2 t -77.54 -17.53 57.84 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.0 m -62.93 -30.45 71.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.941 173.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.45 -29.17 61.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.479 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -79.68 -29.2 40.74 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.569 0.699 . . . . 0.0 109.631 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.628 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.96 44.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.338 176.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.67 -55.02 34.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.898 -175.463 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 7.5 m-80 -71.84 -27.16 62.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.049 0.452 . . . . 0.0 110.221 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.628 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tm? -60.35 -47.52 85.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.535 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -75.39 -28.12 59.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.571 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.471 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 85.2 t80 -63.36 -25.76 68.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 95.2 mt-30 -79.24 -8.6 59.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.592 178.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.867 -177.567 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.488 ' N ' ' HA2' ' A' ' 130' ' ' GLY . 2.0 mpt? . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.0 t -85.57 118.17 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 73.6 m -144.18 172.38 5.57 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.777 -172.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.569 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 51.4 Cg_exo -53.71 160.88 4.98 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.473 2.115 . . . . 0.0 112.439 176.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.567 ' H ' HD12 ' A' ' 5' ' ' ILE . 3.5 mp -58.92 135.11 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.814 -174.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 81.4 -18.51 0.48 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.375 1.07 . . . . 0.0 112.383 173.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.569 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 28.4 m95 -58.97 121.11 10.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 5.2 mpt_? -72.96 103.28 3.71 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.371 -175.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.14 120.85 21.21 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.443 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -128.24 104.77 7.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 61.44 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.612 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -110.63 -37.27 5.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.562 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -101.89 173.25 6.49 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.745 -170.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.562 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 58.0 m -135.57 131.28 35.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 127' ' ' LYS . 69.6 m-85 -118.25 126.14 51.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.815 0.341 . . . . 0.0 111.809 -172.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.49 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 67.0 t80 -111.99 119.61 43.9 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.946 177.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.3 Cg_endo -85.65 134.23 4.64 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.2 2.6 . . . . 0.0 112.184 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 138.66 54.6 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.85 0.357 . . . . 0.0 110.179 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 p -88.68 -4.76 58.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.261 0.553 . . . . 0.0 109.916 174.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 t70 -56.0 139.06 47.81 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.356 178.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 93.7 m-20 -92.82 105.35 17.5 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.609 ' HG3' ' HB2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -139.19 154.08 48.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.775 -178.443 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.5 ' OG1' ' HG2' ' A' ' 26' ' ' GLU . 57.4 p -80.11 168.59 18.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.403 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 23.4 t90 -59.92 -39.83 86.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.041 0.448 . . . . 0.0 110.41 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.12 -48.7 50.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.354 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.609 ' HB2' ' HG3' ' A' ' 22' ' ' LYS . 12.0 mm-40 -69.38 -28.81 66.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.673 0.273 . . . . 0.0 110.821 -177.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.569 ' HB3' HD21 ' A' ' 38' ' ' LEU . 73.2 m -57.94 -45.68 86.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.985 173.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.493 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 6.6 mm-40 -74.78 -18.77 60.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 177.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -73.84 -35.31 64.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.802 0.334 . . . . 0.0 110.923 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.15 -38.91 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.525 0.679 . . . . 0.0 110.022 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.3 m -87.49 179.15 6.61 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.97 174.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.799 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 62.0 m 73.59 -43.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.482 0.313 . . . . 0.0 111.496 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.12 -22.94 65.57 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.907 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mtm -87.51 12.47 12.26 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.162 0.185 . . . . 0.0 110.768 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.457 ' O ' HG13 ' A' ' 128' ' ' ILE . . . 72.61 38.93 57.07 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -172.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.799 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -134.02 -174.27 3.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.949 -0.626 . . . . 0.0 110.512 -171.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.31 168.08 27.29 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 176.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 27' ' ' SER . 41.2 mt -64.79 146.79 54.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.378 0.535 . . . . 0.0 110.799 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.434 ' HG3' ' CE2' ' A' ' 15' ' ' TYR . 23.5 ttt -59.05 126.13 26.43 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 121.451 0.643 . . . . 0.0 111.972 -176.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 33.4 p -118.72 106.96 13.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.717 173.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.6 mt -58.5 104.23 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.733 -176.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.8 m -89.7 -31.36 17.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.789 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 27.3 p -137.42 152.35 49.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.531 0.682 . . . . 0.0 111.604 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.17 -43.41 98.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.688 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.438 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -60.59 -37.15 80.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.497 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' THR . 40.1 tt0 -55.05 -51.39 66.48 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.386 177.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' ILE . 48.1 tt0 -60.03 -47.34 86.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.695 176.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -57.34 -35.26 69.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.889 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.655 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 35.8 m-85 -84.4 -29.2 26.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.4 tp -78.62 -31.1 15.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.047 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.42 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 32.5 pt -72.48 -4.38 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -176.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 11.0 pt20 -87.88 -20.42 26.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 175.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -94.38 -30.14 14.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 81.9 mt -71.09 144.19 50.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.559 -176.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.519 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -76.06 131.85 39.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.381 176.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.562 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 76.7 mtt180 -84.43 27.47 0.7 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -170.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.817 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.0 ptp180 -126.95 -13.78 5.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.699 0.285 . . . . 0.0 110.848 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.817 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -97.66 157.57 15.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.039 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 p -108.96 115.55 30.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.682 174.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB3' HG13 ' A' ' 125' ' ' ILE . 96.2 m-85 -99.55 123.86 44.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -61.39 139.06 58.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.997 0.427 . . . . 0.0 111.824 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.5 mt -114.42 175.49 5.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.145 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.08 -2.37 90.43 Favored Glycine 0 CA--C 1.521 0.468 0 C-N-CA 120.903 -0.665 . . . . 0.0 114.407 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.492 ' HB2' HG22 ' A' ' 102' ' ' VAL . 15.0 mt -79.68 127.48 32.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.809 0.804 . . . . 0.0 110.742 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HG3' ' SG ' ' A' ' 101' ' ' CYS . 35.0 ttt180 -137.63 129.02 28.03 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 19.0 t70 -94.5 147.27 23.43 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 161.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.03 26.77 1.33 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -179.54 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.249 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.59 32.33 21.68 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -167.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 ptpp? -85.26 -19.42 31.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.741 -173.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.32 5.71 59.96 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.397 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -86.58 82.93 7.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 98.7 m95 -69.34 105.88 2.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.362 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -126.43 146.0 50.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.729 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.54 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 76.5 m95 -84.91 139.56 31.76 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.47 -11.8 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.142 0.496 . . . . 0.0 111.689 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.508 ' HB3' HG21 ' A' ' 40' ' ' THR . 32.6 t70 -99.41 29.24 4.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.306 0.574 . . . . 0.0 109.989 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.36 -12.31 0.73 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.33 177.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.3 m -59.38 131.33 87.83 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.113 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.1 Cg_exo -73.97 159.51 44.61 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.889 2.393 . . . . 0.0 112.044 177.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 52.6 t80 -71.29 139.0 49.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.559 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -90.46 114.76 62.27 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.109 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.526 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.8 Cg_exo -74.7 -12.32 22.17 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.115 2.543 . . . . 0.0 112.899 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.526 ' HD2' ' O ' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -123.89 -43.99 2.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.881 0.372 . . . . 0.0 110.764 178.804 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -84.05 52.22 2.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 109.842 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.5 p -98.21 -33.56 4.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.567 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 68.44 -65.19 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.424 0.689 . . . . 0.0 112.67 172.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.418 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 39.7 m95 53.89 -169.06 0.06 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.586 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 1.5 t-80 -99.61 -18.12 17.48 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.896 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 1.7 tttm 83.56 -5.21 1.17 Allowed 'General case' 0 N--CA 1.472 0.652 0 O-C-N 124.336 1.022 . . . . 0.0 110.942 176.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -168.92 72.48 0.09 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.9 0.857 . . . . 0.0 109.998 176.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' OE1' ' HB3' ' A' ' 88' ' ' TRP . 0.4 OUTLIER -123.95 146.13 50.04 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.651 -177.423 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 94.5 Cg_endo -96.62 -170.36 0.15 Allowed 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 123.059 2.506 . . . . 0.0 112.044 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -123.62 101.37 7.27 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -103.11 -30.8 10.5 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.405 0.622 . . . . 0.0 110.073 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.9 t -92.53 63.51 4.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.852 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.47 95.44 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.543 0.687 . . . . 0.0 110.761 177.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 149.15 -71.45 0.31 Allowed Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.513 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 29.8 mt-10 -116.54 81.82 1.69 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 172.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 47.3 t-20 -91.16 99.78 12.73 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.255 0.55 . . . . 0.0 109.917 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' ' HG3' ' A' ' 65' ' ' ARG . 29.8 m -103.5 136.47 43.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.634 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 26.8 m -93.25 138.78 19.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.152 0.501 . . . . 0.0 110.961 -179.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.61 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.5 m -116.26 147.5 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.712 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HG ' ' CE3' ' A' ' 111' ' ' TRP . 22.6 tp -83.18 101.88 11.5 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -124.76 141.23 45.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.063 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.562 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 38.0 t80 -86.34 99.32 11.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.505 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -142.32 136.74 29.99 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 66.22 28.14 10.11 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -171.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.2 t70 72.0 -3.04 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.694 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -113.45 143.31 44.72 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.787 -0.57 . . . . 0.0 110.964 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.43 ' CE3' ' HG ' ' A' ' 104' ' ' LEU . 93.4 m95 -69.28 130.19 41.91 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 169.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.586 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -149.58 166.54 28.95 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.029 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.634 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 42.9 m0 -96.37 119.36 34.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.264 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 1.8 t30 -104.45 146.16 29.25 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.86 136.38 40.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 101' ' ' CYS . 4.5 p -158.67 143.84 11.91 Favored Pre-proline 0 C--N 1.317 -0.806 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.2 129.09 29.74 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.058 1.839 . . . . 0.0 110.609 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.513 ' SG ' ' HB3' ' A' ' 99' ' ' GLU . 61.1 m -57.44 -28.21 63.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.219 0.533 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -90.85 70.66 6.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 170.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.46 ' O ' ' HA ' ' A' ' 23' ' ' THR . 83.9 t80 -138.14 133.69 33.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.528 175.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 28.2 mp0 -74.62 109.72 8.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.052 0.453 . . . . 0.0 110.629 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -142.84 179.62 6.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.027 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 48.9 m -74.35 168.47 19.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -137.06 147.82 46.39 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.695 -167.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.591 HG13 ' HB3' ' A' ' 60' ' ' TYR . 50.3 mt -132.23 122.23 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 168.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' CYS . . . . . 0.407 ' SG ' HD23 ' A' ' 38' ' ' LEU . 82.4 m -118.09 143.54 46.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.221 0.534 . . . . 0.0 111.279 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.496 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 22.2 ptmt -112.97 143.02 44.98 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.5 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.562 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 10.0 tt -118.57 136.26 24.03 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.41 ' HG2' HG23 ' A' ' 131' ' ' THR . 19.3 Cg_endo -59.91 166.95 7.77 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.472 2.115 . . . . 0.0 111.96 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.488 ' HA2' ' N ' ' A' ' 1' ' ' MET . . . -44.14 -39.76 5.45 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.552 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.41 HG23 ' HG2' ' A' ' 129' ' ' PRO . 7.7 p 58.98 -12.07 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 173.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 24.2 p -58.91 -51.77 68.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.601 0.239 . . . . 0.0 110.648 177.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.6 mt -54.26 -24.33 18.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.739 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -87.1 -52.17 5.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.231 0.539 . . . . 0.0 110.229 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.01 22.48 3.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.49 -175.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 132' ' ' THR . 60.2 mm-40 -48.83 -66.14 0.45 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.067 0.46 . . . . 0.0 111.685 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.438 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 92.4 m-20 -74.72 -27.51 60.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.0 -46.22 90.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.76 -24.43 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.432 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 86.5 t80 -67.15 -24.91 65.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 97.6 mt-30 -85.24 -5.19 59.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.439 178.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.831 -177.721 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.513 ' HA ' ' OG1' ' A' ' 132' ' ' THR . 28.1 ttt . . . . . 0 N--CA 1.48 1.062 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.763 ' H ' ' HB ' ' A' ' 132' ' ' THR . 52.7 t -122.29 125.22 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.993 0.425 . . . . 0.0 111.342 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 m -132.44 167.59 21.83 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 172.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.704 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 44.4 Cg_exo -56.66 163.32 7.21 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.221 1.947 . . . . 0.0 112.007 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.4 tp -56.87 122.15 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.3 t70 66.37 6.18 4.16 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.83 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.704 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 14.5 m95 -63.27 122.95 17.43 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 170.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.594 ' HB3' ' HB2' ' A' ' 15' ' ' TYR . 4.8 tpp180 -72.24 97.59 2.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.015 -165.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -76.42 121.78 23.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.051 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.412 ' HB3' ' OD1' ' A' ' 13' ' ' ASN . 85.1 t80 -132.2 102.21 5.69 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.864 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 67.68 -71.59 0.1 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.196 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -145.88 13.53 1.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.754 0.311 . . . . 0.0 111.47 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 26.0 p30 -132.29 169.26 16.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.437 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 92.6 m -139.77 133.87 31.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.965 0.412 . . . . 0.0 110.012 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.815 ' HE2' ' HG2' ' A' ' 39' ' ' MET . 45.4 m-85 -115.03 142.52 46.52 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -170.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -127.72 113.23 20.72 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.003 169.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -89.92 122.95 1.1 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.095 2.53 . . . . 0.0 112.148 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.506 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.6 mp -112.94 138.8 49.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.903 0.382 . . . . 0.0 110.099 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.8 p -105.65 9.5 33.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.497 -176.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -82.38 136.29 35.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.973 0.416 . . . . 0.0 110.015 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.813 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 16.2 m120 -71.49 100.32 2.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.422 -176.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.535 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 21.2 mmmt -127.24 149.66 49.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.386 177.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 61.7 p -75.21 165.58 24.98 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CZ3' ' HD2' ' A' ' 65' ' ' ARG . 68.4 t90 -56.81 -39.04 73.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.114 0.483 . . . . 0.0 110.276 -179.285 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.648 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -63.66 -50.88 67.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.91 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -64.84 -36.83 85.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.157 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.1 t -51.35 -47.82 62.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.189 174.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -74.82 -21.07 59.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.175 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 34.1 mmt-85 -82.7 -32.66 27.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.703 0.287 . . . . 0.0 111.339 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -83.32 -38.82 21.58 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.107 0.479 . . . . 0.0 109.916 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.577 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 96.8 m -85.68 177.8 7.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.798 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 35.7 m 76.88 -33.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.812 0.845 . . . . 0.0 110.511 -172.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.84 -32.75 84.91 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.394 -0.431 . . . . 0.0 112.471 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 pmm? -95.25 1.63 54.63 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.956 0.378 . . . . 0.0 110.448 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.03 -6.41 66.62 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.791 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.516 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.02 140.16 30.35 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.487 ' HD2' ' OD2' ' A' ' 77' ' ' ASP . 33.0 t60 -118.66 165.51 13.89 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.04 133.96 8.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.988 0.423 . . . . 0.0 111.552 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.815 ' HG2' ' HE2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -58.54 103.73 0.17 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.492 0.663 . . . . 0.0 111.03 178.876 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.651 ' HA ' ' HZ3' ' A' ' 75' ' ' TRP . 2.0 t -94.3 118.91 32.3 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.412 168.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.712 HD13 ' HE1' ' A' ' 39' ' ' MET . 25.3 mm -61.3 119.95 6.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.4 m -102.75 -45.45 5.0 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.0 p -136.98 163.08 31.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 111.244 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -64.88 -40.56 95.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.052 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.408 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.47 -45.48 90.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.195 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -54.15 -50.45 66.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.726 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -51.7 -50.36 60.65 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.638 176.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -66.26 -41.43 89.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.951 -177.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.408 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 26.1 m-85 -70.19 -41.29 73.89 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.3 tp -69.96 -34.07 58.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.548 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.44 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 33.8 pt -71.91 -3.26 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 120.885 0.374 . . . . 0.0 111.349 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -87.46 -23.96 24.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.416 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 72.9 m-85 -93.14 -21.21 19.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -73.89 142.48 46.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.5 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 15.1 t70 -67.97 119.61 12.9 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.444 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.3 mtt180 -71.33 60.61 0.3 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.449 0.468 . . . . 0.0 111.742 -177.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 1.9 ttp180 -162.54 -29.32 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.293 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -92.35 173.98 7.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.381 0.61 . . . . 0.0 111.948 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.6 p -122.0 129.51 52.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.145 174.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.677 ' HB3' HG13 ' A' ' 125' ' ' ILE . 68.0 m-85 -114.17 126.23 54.83 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 -173.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.643 ' HA ' HG12 ' A' ' 103' ' ' VAL . 38.7 m-85 -61.98 146.94 48.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.1 mt -113.64 176.77 4.89 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.468 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.92 6.18 67.59 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 115.764 1.066 . . . . 0.0 115.764 -169.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 64' ' ' LEU . 1.4 pt? -103.48 138.54 40.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 118.861 1.331 . . . . 0.0 110.894 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.423 ' HD2' ' CZ3' ' A' ' 24' ' ' TRP . 30.3 ttt180 -136.86 137.81 40.09 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.711 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 7.6 t0 -109.82 154.22 23.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 161.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 2.9 pt-20 -145.02 -1.79 0.83 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -167.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -157.32 26.22 0.3 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.96 45.76 20.68 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.52 0.676 . . . . 0.0 109.229 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 66' ' ' ASP . 35.9 mtmt -70.04 -47.29 62.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.104 -173.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.24 -26.76 8.35 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -173.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -89.14 100.06 12.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.092 -0.554 . . . . 0.0 109.615 176.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.537 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 92.1 m95 -70.97 142.83 51.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.579 0.704 . . . . 0.0 112.089 -175.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -140.47 120.12 13.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.699 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HZ3' ' HA ' ' A' ' 40' ' ' THR . 40.7 m95 -79.15 147.21 32.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.912 175.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.2 p -75.01 -13.21 15.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.504 0.669 . . . . 0.0 109.996 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 4.6 m-20 -90.07 18.99 5.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.049 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 47.1 tp60 76.53 -19.72 0.4 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.231 0.612 . . . . 0.0 111.403 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.9 m -55.73 127.42 67.41 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 120.986 0.422 . . . . 0.0 111.556 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -72.55 158.94 50.08 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.532 2.155 . . . . 0.0 110.464 170.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.537 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 64.0 t80 -64.49 117.88 7.97 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.685 -178.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.563 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -90.72 110.79 43.96 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.706 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.99 -20.69 33.44 Favored 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.521 2.147 . . . . 0.0 112.444 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -104.55 2.88 31.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.523 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.563 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 3.6 mmp_? -123.2 22.48 9.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.116 0.484 . . . . 0.0 110.001 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.486 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.6 p -99.52 140.75 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.174 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -124.15 74.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.82 0.343 . . . . 0.0 110.735 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -63.5 156.55 25.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.223 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.602 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 27.1 t-80 -70.73 -65.36 0.74 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.535 -172.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 16.3 mtpt -154.65 -79.99 0.09 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.73 0.776 . . . . 0.0 109.026 177.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -153.68 23.45 0.52 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.462 ' OE1' ' HB2' ' A' ' 90' ' ' LYS . 6.1 mp0 -57.72 135.07 82.84 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.529 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 9.0 Cg_exo -72.19 146.49 46.11 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.217 2.611 . . . . 0.0 112.645 -177.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -81.41 179.67 7.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.24 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.446 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 3.8 p30 -170.82 92.83 0.18 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.562 0.696 . . . . 0.0 110.843 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 44.5 t -161.96 167.76 24.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.884 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -127.63 12.24 6.85 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 177.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 171.0 -64.92 0.16 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.83 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -85.9 92.32 8.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.5 0.666 . . . . 0.0 110.763 -179.232 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -108.03 115.0 29.32 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.143 0.497 . . . . 0.0 110.207 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.507 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.464 ' CG2' HD21 ' A' ' 64' ' ' LEU . 2.1 m -88.74 147.7 5.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.218 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 61' ' ' PHE . 29.0 m -127.43 154.47 37.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.639 176.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.9 mt -82.87 102.96 11.99 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 170.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.33 142.29 22.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.802 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 91.6 t80 -91.33 114.29 26.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.741 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.518 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -151.3 122.55 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.055 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 61.31 47.41 6.95 Favored 'General case' 0 CA--C 1.518 -0.264 0 O-C-N 123.981 0.8 . . . . 0.0 110.017 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 13.6 t70 73.44 -28.3 0.19 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.936 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -97.7 130.31 44.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.78 0.8 . . . . 0.0 112.383 -171.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.444 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 88.1 m95 -79.42 148.81 31.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.462 171.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.602 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -177.09 177.15 1.29 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.394 0.434 . . . . 0.0 111.012 173.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.486 ' CZ3' HG23 ' A' ' 86' ' ' VAL . 8.9 m0 -78.97 134.74 36.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.936 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -136.19 137.65 41.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -79.89 125.04 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.043 0.449 . . . . 0.0 111.343 -177.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.47 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 23.0 m -143.91 160.12 51.0 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.643 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.568 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 15.9 Cg_endo -58.58 140.36 94.45 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.096 1.864 . . . . 0.0 111.365 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.461 ' HB2' ' HB2' ' A' ' 99' ' ' GLU . 61.6 m -72.02 -23.71 61.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.808 0.337 . . . . 0.0 110.497 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -94.66 53.21 1.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.53 0.681 . . . . 0.0 110.273 174.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.568 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 66.8 t80 -123.64 125.64 45.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.309 176.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.813 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 1.8 mp0 -68.75 109.3 3.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.974 0.416 . . . . 0.0 110.98 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.465 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -142.52 -177.94 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.877 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 37.9 m -80.53 172.21 14.05 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.789 0.328 . . . . 0.0 110.347 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.506 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 12.3 ptt180 -149.65 148.98 29.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.128 0.49 . . . . 0.0 112.101 -171.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.677 HG13 ' HB3' ' A' ' 60' ' ' TYR . 19.2 mt -119.79 121.55 66.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 173.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 87.5 m -112.62 126.32 55.24 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.265 0.555 . . . . 0.0 110.119 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -112.16 124.93 53.5 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.471 -173.677 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.516 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 18.4 tt -106.8 144.2 28.59 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.896 -178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HG13 ' A' ' 128' ' ' ILE . 7.9 Cg_endo -54.97 166.03 2.36 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.796 2.331 . . . . 0.0 112.503 172.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -64.53 89.97 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.548 173.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.6 p -61.21 2.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.763 ' HB ' ' H ' ' A' ' 2' ' ' VAL . 15.1 t -75.18 -5.1 42.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.618 179.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.4 mp -85.26 -26.31 26.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.701 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -88.91 -50.32 6.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -92.45 35.46 1.02 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.347 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.688 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -72.36 -67.99 0.51 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.443 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.688 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 3.8 p30 -86.81 -22.57 25.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 5.4 tt -55.64 -55.72 28.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -75.0 -19.76 59.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.216 0.531 . . . . 0.0 109.964 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.87 -31.51 70.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.043 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 81.6 mm-40 -86.19 -38.63 17.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.621 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.105 -177.211 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.726 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 56.9 ttp . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t -93.24 116.58 34.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 170.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.9 m -159.3 172.45 6.07 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -174.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 42.9 Cg_exo -57.85 152.24 51.43 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.845 1.697 . . . . 0.0 110.979 168.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 15.4 tt -74.61 -18.72 16.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.069 0.461 . . . . 0.0 111.681 -171.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -74.57 -32.19 62.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 34.9 m95 -72.67 128.19 34.82 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 2.0 tpp180 -84.1 121.1 26.97 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.446 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.62 138.76 31.22 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.113 0.482 . . . . 0.0 111.972 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 84.5 t80 -131.53 102.44 5.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.189 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 58.78 -96.51 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.707 -174.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.726 ' HA ' ' HB2' ' A' ' 1' ' ' MET . 19.0 t -105.81 -12.08 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.691 -178.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -93.54 164.49 13.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.697 0.284 . . . . 0.0 111.356 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.9 m -144.12 131.52 20.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.229 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.452 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 2.9 m-85 -123.5 134.77 53.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 -175.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 34.5 t80 -124.62 115.43 26.8 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 174.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -82.57 120.19 3.13 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.13 2.553 . . . . 0.0 112.24 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.653 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -99.29 139.12 35.42 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.995 0.426 . . . . 0.0 110.228 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.0 p -94.43 -3.29 50.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.41 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -65.68 135.68 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.912 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.19 120.75 29.84 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.1 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 43.1 mmtm -144.25 150.97 38.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.363 177.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 119' ' ' ASN . 0.0 OUTLIER -68.96 158.94 33.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 167.098 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.417 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 82.5 t90 -52.48 -47.26 66.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.705 0.288 . . . . 0.0 111.358 -175.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.14 93.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.274 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.64 -27.13 63.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.955 0.407 . . . . 0.0 110.816 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.8 t -62.52 -43.95 97.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.18 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.562 ' OE2' HG11 ' A' ' 76' ' ' VAL . 8.7 tp10 -79.21 -21.39 46.35 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.311 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.32 -31.13 69.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.987 173.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.414 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.5 t-20 -85.41 -28.26 25.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.432 0.634 . . . . 0.0 109.742 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.459 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 80.9 m -84.61 -179.9 7.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 170.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 72.5 m 73.56 -45.79 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.755 0.422 . . . . 0.0 111.193 -175.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.08 -27.6 70.74 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.66 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 75.3 mtm -92.74 7.37 43.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.806 0.336 . . . . 0.0 110.472 176.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.69 -6.28 70.47 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.367 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.779 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.79 -177.71 3.99 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.538 0.209 . . . . 0.0 111.318 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -148.53 169.76 19.57 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.773 0.429 . . . . 0.0 110.009 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.455 ' HB2' HG21 ' A' ' 76' ' ' VAL . 3.7 mm? -55.0 143.65 25.85 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.068 0.23 . . . . 0.0 110.496 173.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.3 tpt -49.6 109.6 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.654 0.596 . . . . 0.0 111.884 -177.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.65 HG22 ' HB3' ' A' ' 75' ' ' TRP . 27.3 p -107.92 106.76 17.17 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.326 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.9 mt -81.62 116.13 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.932 -176.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.3 p -102.89 -31.56 10.2 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.04 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.6 p -131.16 159.44 37.68 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.522 0.677 . . . . 0.0 111.904 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' HE ' ' A' ' 85' ' ' ARG . 19.8 mt-10 -68.42 -39.41 81.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.711 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.26 -33.52 74.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.597 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -58.84 -50.35 74.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.164 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.43 ' O ' HG23 ' A' ' 51' ' ' ILE . 34.3 tt0 -57.63 -55.44 34.76 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 35.2 m-80 -59.17 -36.96 76.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.069 -175.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -69.49 -47.22 64.57 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 121.278 -0.169 . . . . 0.0 111.106 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.452 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 8.8 tp -70.59 -33.98 55.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.011 0.434 . . . . 0.0 111.58 -174.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.806 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.9 pt -71.06 -11.19 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.946 0.403 . . . . 0.0 110.938 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 75.4 mt-30 -76.91 -27.55 54.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.634 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.452 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 55.1 m-85 -90.14 -21.77 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.596 -179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.43 150.07 40.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.262 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -67.84 -13.48 62.17 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.701 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 49.5 mtp180 66.84 30.55 7.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.911 0.386 . . . . 0.0 111.099 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.635 ' HB3' HD22 ' A' ' 58' ' ' LEU . 3.7 ttm180 -132.21 -56.36 0.97 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.832 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 57' ' ' ARG . 2.7 mm? -83.27 170.96 14.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.453 -174.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -111.82 125.72 54.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.468 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.594 ' HB3' HG13 ' A' ' 125' ' ' ILE . 21.3 m-85 -108.76 126.52 53.11 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -171.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.44 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.7 m-85 -60.54 149.94 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.758 ' HB2' HG13 ' A' ' 102' ' ' VAL . 90.4 mt -120.91 -178.93 3.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.298 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.538 ' CA ' HG23 ' A' ' 76' ' ' VAL . . . -81.86 -17.94 68.97 Favored Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.749 -0.738 . . . . 0.0 114.193 -176.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.621 ' HB2' ' CG1' ' A' ' 102' ' ' VAL . 83.7 mt -71.78 121.53 19.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 117.666 0.733 . . . . 0.0 110.455 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 ptm85 -129.19 161.76 29.4 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.597 0.713 . . . . 0.0 112.32 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.672 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 1.8 t70 -135.61 151.52 50.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.676 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.986 ' HG2' ' HD2' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -112.07 -33.51 6.23 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.881 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -161.42 71.3 0.38 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.251 -172.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.81 36.43 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.041 0.448 . . . . 0.0 111.449 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.986 ' HD2' ' HG2' ' A' ' 67' ' ' GLU . 32.3 mtpt -63.03 127.86 33.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.451 -177.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.65 -14.64 82.21 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.118 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 24.8 pt20 -107.8 113.64 27.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.276 0.56 . . . . 0.0 110.251 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.548 ' HB3' HD22 ' A' ' 64' ' ' LEU . 44.9 m95 -99.33 158.65 15.56 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.779 -178.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.509 ' HG2' ' N ' ' A' ' 75' ' ' TRP . 3.6 ttt180 -152.04 149.38 28.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.537 176.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.65 ' HB3' HG22 ' A' ' 40' ' ' THR . 82.4 m95 -82.74 -174.65 5.35 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.568 0.542 . . . . 0.0 109.756 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.562 HG11 ' OE2' ' A' ' 28' ' ' GLU . 35.5 t -81.82 -65.09 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.89 -77.88 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.42 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.0 OUTLIER -153.61 -18.07 0.14 Allowed 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.42 ' H ' ' H ' ' A' ' 78' ' ' GLN . 16.8 m -57.03 118.24 22.76 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.875 -176.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.33 169.71 20.12 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.042 2.495 . . . . 0.0 111.542 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 77.1 t80 -60.49 137.45 58.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 110.001 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -97.24 118.86 64.14 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.784 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.51 -46.61 20.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.327 2.685 . . . . 0.0 113.879 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -85.5 -31.51 22.72 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.589 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -92.08 80.03 5.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 110.133 -176.256 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.0 t -128.61 103.87 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.507 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -127.35 67.51 1.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.338 -173.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.512 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 86.1 m95 -84.93 -166.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.855 0.359 . . . . 0.0 110.595 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.616 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 69.1 m-70 -123.78 116.42 22.97 Favored 'General case' 0 CA--C 1.514 -0.404 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 174.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.454 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.8 tppt? -61.23 110.42 1.4 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.145 0.974 . . . . 0.0 110.881 -177.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.403 ' N ' ' HD3' ' A' ' 90' ' ' LYS . 24.5 t-20 160.58 -51.99 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 112.507 -2.133 . . . . 0.0 107.393 -171.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.454 ' OE2' ' HA ' ' A' ' 90' ' ' LYS . 2.2 mp0 35.66 94.78 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.546 0 O-C-N 124.94 1.4 . . . . 0.0 111.77 -176.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -61.18 99.42 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.377 2.718 . . . . 0.0 114.04 -170.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.09 67.88 7.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.949 0.88 . . . . 0.0 108.856 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -122.46 -28.8 4.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.95 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.1 m -140.56 90.42 2.35 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.741 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.492 ' H ' ' CD ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -80.91 109.65 15.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.508 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.18 143.28 5.75 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 -176.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 66' ' ' ASP . 19.0 mt-10 55.88 33.74 22.2 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -177.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 66' ' ' ASP . 0.9 OUTLIER -75.69 93.75 3.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.544 0.688 . . . . 0.0 110.717 -178.469 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.3 m -102.45 139.66 37.77 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.758 HG13 ' HB2' ' A' ' 62' ' ' LEU . 13.8 p -91.53 145.68 7.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -169.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.44 HG12 ' HA ' ' A' ' 61' ' ' PHE . 19.8 m -128.84 155.28 40.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.595 174.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD11 ' A' ' 62' ' ' LEU . 23.1 mt -88.35 118.92 28.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 171.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -130.37 141.62 45.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.42 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -75.64 108.37 8.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.703 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.426 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.9 t-20 -159.08 143.18 15.3 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -177.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 66.73 35.33 5.19 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.314 0.578 . . . . 0.0 109.748 -173.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.69 4.11 4.85 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 114.548 -1.206 . . . . 0.0 112.691 174.418 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.5 175.44 10.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.882 0.372 . . . . 0.0 110.288 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.806 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 82.2 m95 -85.69 137.64 32.68 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 173.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.616 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -154.93 174.22 15.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.481 176.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.512 ' HB2' ' HA ' ' A' ' 88' ' ' TRP . 51.9 m0 -81.04 136.5 35.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.522 -172.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -129.93 130.07 44.64 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.112 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.82 123.92 27.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.193 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.24 158.63 63.72 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.529 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.43 135.89 67.51 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.332 2.021 . . . . 0.0 111.018 171.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -27.39 66.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.762 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.445 ' HA ' HG22 ' A' ' 23' ' ' THR . 3.8 p30 -86.67 60.34 6.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.824 0.821 . . . . 0.0 110.639 175.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -137.25 116.78 12.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.059 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -63.1 117.98 7.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.071 0.462 . . . . 0.0 111.632 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.412 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -144.39 -176.39 5.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.89 176.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.3 m -78.51 171.82 14.56 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.653 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -152.45 135.66 15.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -167.931 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.594 HG13 ' HB3' ' A' ' 60' ' ' TYR . 67.6 mt -105.85 127.45 60.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 172.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.74 121.95 45.75 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -112.28 129.2 56.36 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.897 -175.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.779 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.2 tt -129.87 141.13 40.78 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -70.9 166.8 27.84 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.087 1.858 . . . . 0.0 110.57 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.38 57.74 1.57 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.964 176.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -106.07 17.52 23.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.078 0.466 . . . . 0.0 110.98 -173.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 m -61.05 -20.08 62.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.148 0.499 . . . . 0.0 111.228 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.47 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.0 mp -79.84 -26.94 40.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.668 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -88.04 -37.54 16.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.221 0.534 . . . . 0.0 109.91 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.14 40.56 0.99 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.738 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.488 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.58 -57.36 11.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.986 -174.421 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.488 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 9.3 m-80 -74.26 -24.03 59.22 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.75 0.309 . . . . 0.0 110.625 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.97 -51.68 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -70.74 -23.52 62.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.394 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -70.88 -31.72 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.547 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -89.03 -6.37 57.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.456 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.833 -177.314 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.3 m -93.43 165.0 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 169.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB2' HG21 ' A' ' 132' ' ' THR . 72.8 m -110.03 114.23 56.27 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-O 120.981 0.419 . . . . 0.0 112.052 -175.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.88 169.17 19.69 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.829 2.352 . . . . 0.0 110.915 171.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.5 pt -72.27 -18.51 19.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.92 -49.49 70.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.985 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.506 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 25.2 m95 -62.05 139.24 58.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.889 178.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 14.1 mmm180 -84.71 129.51 34.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 111.315 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.37 121.46 42.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.933 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.48 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.4 t80 -121.41 105.16 10.25 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 69.55 -61.98 0.43 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.009 0.818 . . . . 0.0 110.956 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.8 m -152.31 -25.83 0.17 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.795 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -82.9 156.46 23.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -175.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.623 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 23.5 m -120.05 137.71 53.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.134 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.48 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 16.7 m-85 -131.8 135.15 46.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.651 0.262 . . . . 0.0 110.72 -175.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.506 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 41.5 t80 -134.17 117.16 13.5 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.128 175.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -84.65 129.31 4.15 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.727 2.285 . . . . 0.0 112.258 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -104.75 139.35 39.68 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.835 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.5 p -105.53 3.31 29.26 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.214 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -88.08 137.2 32.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.658 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 94.5 m-20 -74.51 122.97 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.279 0.561 . . . . 0.0 111.587 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.596 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 43.7 mmtm -141.19 151.31 43.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.01 175.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 63.5 p -73.07 170.44 14.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 172.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.65 ' HZ3' ' HE ' ' A' ' 65' ' ' ARG . 20.8 t90 -62.6 -35.93 81.11 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.285 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.595 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -62.76 -51.62 66.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.55 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.596 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 11.0 mm-40 -61.53 -34.65 75.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.777 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.575 ' HB3' HD11 ' A' ' 38' ' ' LEU . 56.4 m -64.9 -45.07 87.46 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.367 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 17.2 pt-20 -73.74 -24.92 59.96 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.07 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.5 mtm180 -78.63 -49.67 12.82 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.874 0.369 . . . . 0.0 111.166 177.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.32 -31.53 71.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' SER . 1.3 t -84.52 177.94 7.9 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 172.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 20.6 m 76.88 -46.54 0.51 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 122.506 0.322 . . . . 0.0 110.675 -176.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.63 -33.15 75.95 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 121.221 -0.514 . . . . 0.0 111.937 174.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -79.57 2.07 23.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.849 0.356 . . . . 0.0 110.745 176.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.13 47.85 17.03 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.658 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -148.54 -177.41 5.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -150.64 169.52 21.38 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 173.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.643 ' HB2' HG21 ' A' ' 76' ' ' VAL . 4.1 mm? -57.18 138.8 54.16 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 171.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.411 ' CE ' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -48.88 108.64 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.844 0.715 . . . . 0.0 112.325 -173.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -93.33 88.97 6.18 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.723 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.411 HG12 ' CE ' ' A' ' 39' ' ' MET . 48.2 mt -57.17 111.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.083 -176.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.1 m -93.0 -32.7 14.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.78 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 2.9 t -138.75 153.85 48.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.0 112.128 -177.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' NH1' ' A' ' 85' ' ' ARG . 23.0 mt-10 -61.5 -35.26 77.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.79 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -63.58 -34.94 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.224 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.493 ' HB3' ' O ' ' A' ' 43' ' ' THR . 57.8 tt0 -61.0 -51.41 69.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.316 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' HA ' HG22 ' A' ' 50' ' ' ILE . 50.6 tt0 -62.51 -40.35 96.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.064 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.99 -27.86 69.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 20.8 m-85 -88.3 -34.28 17.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.608 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -69.05 -33.39 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.861 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.5 pt -71.29 -4.45 4.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.86 0.362 . . . . 0.0 111.141 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.93 -27.46 26.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.717 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -89.91 -27.03 20.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.385 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.3 mt -74.89 129.45 37.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.168 -176.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.411 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.8 t70 -57.17 125.85 24.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.753 174.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.428 ' HG2' ' HE1' ' A' ' 111' ' ' TRP . 18.0 mtp180 -75.15 59.23 0.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.578 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.532 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -161.9 -30.93 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.724 177.379 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.532 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -84.26 172.62 11.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.0 -178.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 m -122.38 122.73 39.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.26 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB3' HG13 ' A' ' 125' ' ' ILE . 70.6 m-85 -110.37 122.04 46.74 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -170.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.583 ' HA ' HG12 ' A' ' 103' ' ' VAL . 39.6 m-85 -60.49 130.54 47.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.964 0.411 . . . . 0.0 111.361 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.516 HD21 ' HB2' ' A' ' 104' ' ' LEU . 95.7 mt -99.95 174.37 6.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.197 178.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.495 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.75 47.95 3.9 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.322 -177.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.32 126.97 49.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.705 0.253 . . . . 0.0 110.359 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.65 ' HE ' ' HZ3' ' A' ' 24' ' ' TRP . 8.1 ttm180 -124.61 124.12 41.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 176.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.476 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 39.1 t0 -116.96 153.72 32.13 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 163.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.677 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 27.9 tt0 -146.87 108.58 4.34 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.278 -168.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.433 ' HA ' ' HA2' ' A' ' 98' ' ' GLY . 18.2 m120 68.53 23.83 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.744 0.653 . . . . 0.0 110.674 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.476 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 62.27 84.74 0.13 Allowed 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.985 0.803 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HZ3' ' HB3' ' A' ' 67' ' ' GLU . 64.7 mttp -100.02 157.25 16.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.331 177.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -84.71 -12.34 75.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.094 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -123.8 102.34 7.75 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.338 0.589 . . . . 0.0 110.415 178.241 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 11.7 m0 -78.51 167.91 20.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.272 178.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.612 ' NH2' ' HA ' ' A' ' 78' ' ' GLN . 43.8 ttt-85 -144.11 143.6 31.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.277 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.495 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 67.7 m95 -78.75 167.17 21.59 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 38' ' ' LEU . 69.4 t -60.06 -50.44 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.782 0.325 . . . . 0.0 110.999 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -96.94 77.79 2.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.964 0.411 . . . . 0.0 111.383 -174.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.612 ' HA ' ' NH2' ' A' ' 74' ' ' ARG . 44.5 tp60 69.36 -48.59 0.6 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 169.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 24.1 m -48.69 126.74 13.48 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 122.861 0.464 . . . . 0.0 112.083 -173.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 5.2 Cg_exo -76.6 166.33 27.42 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.979 2.453 . . . . 0.0 111.776 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.563 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 84.1 t80 -53.82 132.79 42.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.14 0.495 . . . . 0.0 110.998 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -112.73 112.78 50.63 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.498 -175.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -67.43 -16.17 47.05 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.181 2.587 . . . . 0.0 112.929 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.411 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.5 tpp180 -100.48 -20.42 15.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.432 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.469 ' NH1' ' HG3' ' A' ' 44' ' ' GLU . 8.6 tpp180 -114.28 70.49 0.73 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.53 0.681 . . . . 0.0 110.11 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.1 p -151.27 142.07 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.754 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -118.3 -37.88 3.27 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.882 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.462 ' O ' ' HB1' ' A' ' 112' ' ' ALA . 99.3 m95 59.11 -165.02 0.2 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.139 -174.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.562 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 12.0 t-80 -111.68 -61.52 1.69 Allowed 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.031 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.452 ' HE3' ' HB3' ' A' ' 90' ' ' LYS . 1.9 tmmt? 173.27 -36.63 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 124.007 0.817 . . . . 0.0 109.194 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -151.43 115.88 5.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.081 171.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.524 ' H ' ' CD ' ' A' ' 92' ' ' GLU . 3.3 pm0 -57.97 122.7 59.74 Favored Pre-proline 0 C--N 1.315 -0.932 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.651 173.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 9.9 Cg_endo -90.45 129.43 1.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.114 2.542 . . . . 0.0 112.643 -178.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -73.42 115.77 13.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.401 0.62 . . . . 0.0 110.357 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 175.6 -44.8 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.477 -1.238 . . . . 0.0 107.749 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 6.0 p -87.31 74.16 9.52 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.325 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -111.77 127.23 55.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.433 ' HA2' ' HA ' ' A' ' 68' ' ' ASN . . . 93.49 -55.36 2.37 Favored Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -171.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.691 ' HB3' ' H ' ' A' ' 118' ' ' CYS . 40.0 mt-10 -114.09 104.2 11.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 171.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.54 ' HB3' ' O ' ' A' ' 96' ' ' SER . 2.1 p-10 -138.66 93.21 2.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 122.002 0.906 . . . . 0.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 97.5 m -110.28 121.99 46.6 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.878 177.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 35.3 m -74.4 136.49 25.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.311 0.577 . . . . 0.0 111.442 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.583 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.8 m -116.89 154.93 18.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.609 176.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.516 ' HB2' HD21 ' A' ' 62' ' ' LEU . 13.8 tp -83.59 100.86 11.08 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -120.18 143.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.433 0.635 . . . . 0.0 111.784 -171.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 56' ' ' ARG . 65.5 t80 -83.61 97.03 8.85 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.76 176.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.522 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -143.83 131.48 21.25 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 85.6 mt-30 66.62 29.34 8.9 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 123.824 0.703 . . . . 0.0 109.302 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 t70 72.82 -14.61 0.57 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.625 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -108.23 138.73 44.02 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.394 0.616 . . . . 0.0 111.245 -176.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.428 ' HE1' ' HG2' ' A' ' 56' ' ' ARG . 92.8 m95 -74.68 131.83 41.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.14 176.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.562 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -160.78 167.36 26.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.765 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 14.7 m0 -80.2 121.46 25.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.785 -177.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -123.83 130.89 53.34 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.531 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.09 125.02 25.77 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.8 m -137.2 159.49 69.51 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.201 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.6 134.99 47.95 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.054 1.836 . . . . 0.0 110.577 172.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.691 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 61.0 m -69.17 -35.43 76.29 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.805 0.336 . . . . 0.0 110.364 -175.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.519 ' HA ' ' HB ' ' A' ' 23' ' ' THR . 5.6 t30 -85.49 72.55 10.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.594 0.712 . . . . 0.0 109.412 170.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 23' ' ' THR . 84.9 t80 -137.85 131.59 31.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.95 -1.023 . . . . 0.0 108.798 176.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 26.0 mp0 -75.28 110.15 9.38 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.979 0.419 . . . . 0.0 110.878 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.513 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -146.76 -177.25 5.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.199 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 16.1 m -79.37 173.98 12.03 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.729 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 13.4 ptt180 -154.65 158.84 40.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.818 0.342 . . . . 0.0 111.686 -171.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.598 HG13 ' HB3' ' A' ' 60' ' ' TYR . 49.3 mt -127.17 126.6 68.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.874 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 17.9 m -103.09 131.57 49.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 174.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -119.2 131.31 55.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.032 -176.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.623 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 81.1 mt -107.81 134.23 20.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.126 173.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -67.01 166.33 23.26 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.215 1.943 . . . . 0.0 111.344 177.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.09 54.61 1.44 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.132 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 8.9 t -99.14 -19.06 17.37 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.816 -0.226 . . . . 0.0 110.897 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.456 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 4.4 t -65.93 -37.08 85.12 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 91.0 mt -58.83 -33.61 70.6 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.069 0.461 . . . . 0.0 111.27 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -81.61 -31.25 32.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.306 0.574 . . . . 0.0 109.678 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.51 7.8 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.052 -177.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 133' ' ' LEU . 50.6 mm-40 -62.88 -38.1 89.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 8.7 t30 -69.44 -32.95 72.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.975 176.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.28 -43.84 85.23 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -71.83 -20.75 61.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -68.93 -30.73 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.409 0.623 . . . . 0.0 109.635 173.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 80.3 mt-30 -86.53 -41.26 14.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.985 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.665 -177.88 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HA ' HG21 ' A' ' 132' ' ' THR . 4.2 ppp? . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.516 HG12 ' CG2' ' A' ' 132' ' ' THR . 3.2 p -154.56 124.48 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 121.381 0.61 . . . . 0.0 110.646 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 m -160.36 156.6 23.16 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -57.25 146.89 79.79 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.01 1.806 . . . . 0.0 110.994 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.86 -27.8 28.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.195 0.521 . . . . 0.0 110.753 -174.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -71.61 -34.88 70.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.079 176.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -69.88 141.86 53.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.679 ' HD3' ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -91.41 112.16 23.95 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.715 -174.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.79 133.53 35.12 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.022 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 79.1 t80 -138.68 102.57 4.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.977 178.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 63.74 -81.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.966 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.0 m -135.88 12.77 3.39 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.922 0.391 . . . . 0.0 110.986 -176.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -128.02 158.14 38.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.238 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 75.4 m -136.32 127.76 28.52 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 0.0 110.093 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 13.2 m-85 -118.54 138.49 52.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.383 -173.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -118.63 112.81 36.79 Favored Pre-proline 0 C--N 1.318 -0.789 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.884 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -89.8 121.56 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.197 2.598 . . . . 0.0 112.336 178.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.807 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.1 mm? -107.74 138.89 43.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.085 0.469 . . . . 0.0 110.884 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 p -90.87 -5.41 55.58 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.886 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.03 130.35 46.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.201 -1.363 . . . . 0.0 111.201 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -80.49 112.02 17.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.214 -175.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.654 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 39.2 mmtm -143.49 151.15 39.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.866 178.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 43.1 p -74.74 172.21 12.55 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 70.0 t90 -57.04 -41.53 78.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.091 0.472 . . . . 0.0 110.607 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -67.29 -45.19 77.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.397 -178.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 42.8 mt-10 -64.48 -36.63 84.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.46 -177.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -56.69 -44.71 81.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.761 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -79.53 -21.52 45.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.584 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 96.7 mtt180 -69.65 -40.15 76.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.895 0.379 . . . . 0.0 110.766 176.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -78.21 -31.23 49.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.346 0.593 . . . . 0.0 110.151 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 89.0 m -86.89 179.52 6.71 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.324 174.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 70.1 m 74.02 -40.15 0.45 Allowed 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.493 0.717 . . . . 0.0 110.472 -172.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.94 73.6 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 170.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.9 mtm -92.88 7.04 45.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.825 0.345 . . . . 0.0 110.542 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.05 -14.64 48.22 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.664 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' CYS . . . -95.32 141.69 28.6 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.775 -0.25 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.555 ' CD2' HG13 ' A' ' 76' ' ' VAL . 19.9 t60 -118.31 150.52 39.35 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.3 mp -44.77 131.61 6.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.909 0.385 . . . . 0.0 111.929 -175.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.8 ttt -54.0 117.75 3.46 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.736 -169.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.575 HG21 ' OD1' ' A' ' 77' ' ' ASP . 19.2 p -104.79 97.07 7.01 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.22 174.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.09 113.17 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.408 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 m -94.66 -35.43 12.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.659 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 1.8 t -131.31 151.52 51.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.667 0.746 . . . . 0.0 111.887 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -59.83 -35.96 75.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.961 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.462 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.84 -41.06 97.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.997 0.427 . . . . 0.0 110.206 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.4 tt0 -55.02 -50.75 68.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.984 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.45 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.9 tt0 -65.57 -49.24 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 178.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -59.33 -28.07 66.49 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -175.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.462 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 23.8 m-85 -85.97 -42.79 13.71 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.655 178.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.3 tp -68.17 -30.51 48.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.203 -175.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.642 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.0 pt -73.41 -2.64 3.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.479 -177.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -87.62 -23.12 24.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.826 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.679 ' CE1' ' HD3' ' A' ' 8' ' ' ARG . 83.1 m-85 -95.78 -24.95 16.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.602 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -69.51 141.92 53.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.286 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 13.7 t70 -70.03 117.5 11.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.536 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 80.6 mtt180 -76.34 55.79 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.302 0.572 . . . . 0.0 111.405 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 4.2 ttp180 -154.16 -32.68 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.22 152.78 18.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.054 0.454 . . . . 0.0 111.196 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 p -102.0 122.8 44.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.657 173.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.555 ' HB3' HG13 ' A' ' 125' ' ' ILE . 82.7 m-85 -102.25 127.57 49.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.369 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.557 ' HA ' HG12 ' A' ' 103' ' ' VAL . 26.6 m-85 -65.35 139.32 58.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.928 0.394 . . . . 0.0 111.577 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' A' ' 104' ' ' LEU . 86.2 mt -111.69 172.81 6.67 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.324 176.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -77.51 -5.36 85.86 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.535 -177.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.566 HD11 ' HB3' ' A' ' 73' ' ' TRP . 28.6 tp -73.68 115.65 13.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.266 0.533 . . . . 0.0 110.113 -178.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 67' ' ' GLU . 21.4 ttm180 -113.04 144.05 43.26 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.394 -172.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.494 ' N ' ' HG2' ' A' ' 65' ' ' ARG . 11.3 t0 -129.69 127.07 39.76 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 153.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 65' ' ' ARG . 1.0 OUTLIER -105.89 14.38 28.12 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -172.211 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.544 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -163.95 17.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.93 178.427 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.33 40.13 31.49 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.502 0.668 . . . . 0.0 109.844 -174.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.653 ' HE2' ' HB2' ' A' ' 72' ' ' GLN . 14.2 mtmm -71.53 -24.9 62.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.736 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.26 6.7 70.86 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -174.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.653 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . 74.0 mt-30 -117.66 90.22 3.29 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.473 -178.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.566 ' HB3' HD11 ' A' ' 64' ' ' LEU . 98.6 m95 -72.26 129.92 39.57 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.167 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 62.8 mtm180 -132.48 142.7 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.437 ' CE3' HG22 ' A' ' 40' ' ' THR . 98.2 m95 -74.16 169.91 16.6 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.886 0.374 . . . . 0.0 110.452 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.555 HG13 ' CD2' ' A' ' 37' ' ' HIS . 12.7 p -78.78 -3.4 5.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.175 0.512 . . . . 0.0 111.723 -170.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.575 ' OD1' HG21 ' A' ' 40' ' ' THR . 3.4 p-10 -98.89 -80.79 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 175.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.473 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 0.9 OUTLIER -160.14 -23.77 0.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.006 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.6 m -54.53 130.49 63.17 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.805 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 2.9 Cg_exo -77.15 165.78 27.5 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.903 2.402 . . . . 0.0 111.536 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.582 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 91.4 t80 -58.27 132.33 53.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.003 0.43 . . . . 0.0 110.692 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.547 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 0.8 OUTLIER -85.5 122.85 73.38 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.059 -176.862 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -60.99 -18.42 57.5 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.853 2.369 . . . . 0.0 113.359 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 84' ' ' ARG . 38.6 mtt180 -113.34 16.96 18.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 111.35 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.547 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 19.8 mmt180 -120.57 80.24 1.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 171.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.5 t -126.81 105.04 13.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.032 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.45 96.14 4.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.875 -177.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -121.21 -173.63 2.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.934 0.397 . . . . 0.0 110.625 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 95.4 m-70 -108.74 -166.25 1.1 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 91' ' ' ASN . 2.0 tmtp? -110.33 119.37 39.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.472 ' N ' ' HD3' ' A' ' 90' ' ' LYS . 17.7 t-20 61.45 76.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.191 0.932 . . . . 0.0 110.819 -179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -95.2 156.94 37.21 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 118.26 5.22 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.856 2.371 . . . . 0.0 113.286 -176.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -82.64 3.29 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.876 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -94.44 4.14 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -171.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.5 m -85.47 78.82 9.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.256 0.55 . . . . 0.0 110.24 178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -104.71 148.21 26.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.89 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 149.54 -108.77 0.41 Allowed Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.789 ' HG2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -104.89 -44.31 4.86 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 172.13 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.9 t30 78.27 118.16 0.06 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.164 0.986 . . . . 0.0 113.477 169.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.46 152.98 46.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.236 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.614 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 27.5 m -98.36 140.62 17.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.236 0.541 . . . . 0.0 111.209 179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.557 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.2 m -122.96 153.1 27.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 174.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' A' ' 62' ' ' LEU . 15.0 mt -82.89 110.58 18.01 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 173.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.7 p -123.56 136.98 58.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.683 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 58.0 t80 -82.06 96.15 7.67 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.353 176.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 108' ' ' GLN . 27.0 t-20 -143.89 135.33 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 52.4 mt-30 67.87 27.67 7.24 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -173.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 59.55 17.79 6.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.295 -1.321 . . . . 0.0 112.699 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -130.8 136.23 48.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.004 0.43 . . . . 0.0 110.251 175.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.642 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 80.0 m95 -76.65 104.45 7.16 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.683 175.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -137.83 160.99 37.78 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.215 -178.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.614 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 25.0 m0 -72.91 149.45 43.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -176.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -137.37 131.19 31.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.364 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.35 123.74 21.58 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 123.655 0.597 . . . . 0.0 110.547 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 18.6 m -146.52 151.66 43.77 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.586 177.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.69 135.53 62.45 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.201 1.934 . . . . 0.0 110.683 172.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.789 ' SG ' ' HG2' ' A' ' 99' ' ' GLU . 46.6 m -67.67 -20.6 65.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.916 0.389 . . . . 0.0 110.579 -176.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -91.43 66.72 5.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.464 0.65 . . . . 0.0 109.305 173.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -137.67 114.4 10.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.824 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.02 109.87 1.62 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.114 0.483 . . . . 0.0 110.826 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.462 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -143.54 -171.19 3.46 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.964 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 57.3 m -82.52 173.06 12.32 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.807 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -150.48 152.94 35.0 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -167.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.555 HG13 ' HB3' ' A' ' 60' ' ' TYR . 55.9 mt -136.97 131.41 46.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.96 177.305 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 90.2 m -120.24 143.89 48.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.184 0.516 . . . . 0.0 110.688 176.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -120.44 129.79 54.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.294 -0.867 . . . . 0.0 111.043 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.6 tt -124.22 144.89 46.83 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.93 156.49 43.69 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 121.7 1.6 . . . . 0.0 110.48 169.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -62.8 -11.09 35.03 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.003 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 58.5 p 62.96 -14.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.803 1.241 . . . . 0.0 113.501 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.654 ' HB ' ' HG2' ' A' ' 136' ' ' GLU . 23.1 p -79.16 -3.1 43.99 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.908 ' H ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -54.36 -33.64 59.51 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.303 172.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.652 ' H ' HD22 ' A' ' 133' ' ' LEU . 51.4 t-20 -90.89 -44.07 9.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.266 168.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.575 ' HB3' ' HA ' ' A' ' 132' ' ' THR . . . -86.24 0.83 52.86 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -164.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.654 ' HG2' ' HB ' ' A' ' 132' ' ' THR . 5.1 mm-40 -68.71 -44.63 73.49 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.503 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 44.2 t30 -71.48 -34.8 70.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.013 176.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.58 -46.45 89.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -66.01 -31.02 71.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.171 177.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.54 -42.54 67.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.212 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.5 mm-40 -78.05 -14.7 59.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.726 -175.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.346 -178.55 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 p -147.0 157.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.709 0.29 . . . . 0.0 110.992 -175.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.638 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.6 m -134.71 -178.8 0.93 Allowed Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.638 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 81.7 Cg_exo -48.48 150.2 6.03 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 121.828 1.685 . . . . 0.0 111.655 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.07 -17.17 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -169.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -78.75 -33.0 46.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.069 0.461 . . . . 0.0 109.964 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.458 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 76.2 m95 -79.92 115.78 19.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.6 tpt180 -72.81 104.67 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.214 0.53 . . . . 0.0 110.358 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.2 133.27 42.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.198 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -134.73 102.24 5.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.411 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.73 -82.89 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.554 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.6 m -133.49 2.38 3.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.821 0.344 . . . . 0.0 111.389 -177.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -117.79 162.9 17.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.8 m -137.98 133.43 33.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.807 0.337 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -127.12 127.9 45.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.716 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.506 ' CD2' HD22 ' A' ' 18' ' ' LEU . 49.2 t80 -104.11 113.23 65.46 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 8.5 Cg_endo -89.96 119.41 0.81 Allowed 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 123.537 2.824 . . . . 0.0 111.597 174.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.506 HD22 ' CD2' ' A' ' 16' ' ' PHE . 1.1 pt? -135.31 140.57 45.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.448 0.642 . . . . 0.0 110.821 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 34.0 p -101.54 17.71 22.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.92 -172.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -73.23 141.37 47.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 18.5 m120 -67.8 118.7 11.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.571 -178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.89 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 2.3 mmpm? -159.89 146.91 16.38 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.582 0.753 . . . . 0.0 109.519 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.491 HG23 ' OE2' ' A' ' 121' ' ' GLU . 58.1 p -82.32 177.83 8.56 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.218 178.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 84.0 t90 -61.02 -45.68 93.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.91 82.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.595 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.89 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 21.9 mm-40 -63.6 -38.48 91.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.46 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.526 ' OG ' HD13 ' A' ' 38' ' ' LEU . 34.3 t -60.65 -48.66 80.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.803 0.335 . . . . 0.0 110.247 177.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -66.73 -27.02 67.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.67 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -82.83 -46.18 13.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.136 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -69.84 -35.52 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.521 0.677 . . . . 0.0 109.959 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 32' ' ' SER . 69.1 m -87.97 179.5 6.42 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.204 171.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.832 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 63.4 m 78.98 -43.39 0.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 122.905 0.482 . . . . 0.0 110.62 -174.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.82 -14.49 63.13 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.782 172.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.5 mtm -98.61 11.61 37.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.586 0.231 . . . . 0.0 110.9 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.12 -2.24 87.9 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.926 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.832 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -98.38 -173.88 2.68 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.683 0.393 . . . . 0.0 110.208 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CD2' HG13 ' A' ' 76' ' ' VAL . 4.5 t60 -149.19 155.32 40.46 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.526 HD13 ' OG ' ' A' ' 27' ' ' SER . 23.1 tp -56.37 131.51 48.47 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 125' ' ' ILE . 21.4 ttt -50.46 125.78 13.62 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -168.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 16.9 p -118.18 102.67 9.18 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.377 176.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -73.29 112.67 9.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.646 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.9 t -102.91 -29.68 11.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.513 -177.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 71.0 p -123.3 151.39 42.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.555 0.693 . . . . 0.0 112.049 -175.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -63.1 -40.2 96.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.102 179.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.41 -38.58 90.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.589 177.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 43' ' ' THR . 88.7 tt0 -54.85 -50.77 67.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.882 175.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.599 HE22 ' HE1' ' A' ' 113' ' ' TRP . 5.8 tp-100 -59.16 -53.87 53.46 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 177.011 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.257 -175.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.587 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 47.5 m-85 -88.33 -18.66 27.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -175.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.1 tp -82.49 -31.97 10.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.272 -0.571 . . . . 0.0 111.153 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.1 pt -67.9 -9.39 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 30.2 pt20 -86.44 -21.67 26.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.842 0.353 . . . . 0.0 110.561 177.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -89.72 -30.04 18.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.055 0.455 . . . . 0.0 109.934 178.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 52.6 mt -68.84 147.27 51.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.002 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.466 ' HB3' HD23 ' A' ' 58' ' ' LEU . 14.7 t70 -85.09 131.77 34.41 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.401 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.7 mtt85 -78.03 14.47 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.314 -170.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 ttm-85 -105.86 -26.31 11.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.783 0.325 . . . . 0.0 110.726 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' A' ' 55' ' ' ASP . 3.1 mm? -98.51 175.24 6.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.519 0.676 . . . . 0.0 112.119 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.4 m -128.96 122.97 31.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.105 -0.952 . . . . 0.0 108.828 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -108.21 122.88 47.84 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -172.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.453 ' CD2' ' HB3' ' A' ' 122' ' ' ALA . 6.6 m-85 -67.38 140.49 57.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.81 HD11 ' HG ' ' A' ' 104' ' ' LEU . 93.4 mt -121.75 155.81 34.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.234 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.82 44.68 2.81 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.228 -0.51 . . . . 0.0 114.318 -172.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.495 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.7 tp -100.5 115.84 31.05 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -116.91 119.7 36.18 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -167.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.54 154.67 17.14 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 160.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.677 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.9 tt0 -137.74 86.63 2.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.026 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.816 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 2.3 t-20 71.94 36.3 1.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.319 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.34 67.21 0.74 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.672 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 53.0 mttp -94.78 -23.04 17.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.774 178.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.26 -19.93 12.0 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.133 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.448 ' HG2' ' HB3' ' A' ' 70' ' ' LYS . 12.0 pt20 -83.86 92.98 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.319 0.58 . . . . 0.0 110.588 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.626 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 89.9 m95 -65.47 104.99 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.063 177.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -123.18 133.62 54.22 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.529 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 97.0 m95 -73.44 151.47 41.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.401 HG13 ' CD2' ' A' ' 37' ' ' HIS . 9.9 p -70.42 -5.84 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -172.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.3 p-10 -106.81 10.37 30.76 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 122.224 -0.297 . . . . 0.0 110.207 177.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 78' ' ' GLN . 5.2 tt0 81.04 6.36 1.33 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 124.275 0.984 . . . . 0.0 111.436 178.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.529 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 41.3 m -61.46 121.83 66.45 Favored Pre-proline 0 C--O 1.237 0.42 0 CA-C-O 121.008 0.432 . . . . 0.0 110.28 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -63.48 145.4 92.11 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 123.082 2.521 . . . . 0.0 112.544 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.626 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 71.9 t80 -61.52 134.26 56.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.108 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.545 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -95.23 106.71 27.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.275 175.296 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 27.3 Cg_exo -62.96 -24.86 74.04 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.631 2.22 . . . . 0.0 112.486 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -99.21 3.68 46.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.325 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.545 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 76.2 mtt180 -134.82 30.26 3.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.853 0.359 . . . . 0.0 111.32 -177.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.481 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 4.9 p -87.86 98.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.759 0.79 . . . . 0.0 109.552 174.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.38 74.14 10.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.481 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -64.23 156.35 29.04 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 173.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.639 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 24.7 t-80 -67.93 -34.93 77.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.606 -173.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.507 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 7.8 ttpm? 176.55 -75.39 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 28.1 t-20 -135.68 -0.5 2.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.637 0.732 . . . . 0.0 109.423 177.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.507 ' OE1' ' HB3' ' A' ' 90' ' ' LYS . 1.9 mp0 -77.45 115.4 49.14 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.888 -174.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 2.2 Cg_endo -82.86 -11.18 10.23 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 123.022 2.482 . . . . 0.0 110.527 169.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.57 -161.0 0.22 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.53 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -114.55 6.01 15.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -169.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -88.74 162.35 16.29 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.476 0.655 . . . . 0.0 112.466 -172.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.422 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 90.2 mt-30 -138.99 -157.32 0.76 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.763 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 99' ' ' GLU . . . -40.95 129.95 3.33 Favored Glycine 0 C--N 1.336 0.576 0 O-C-N 123.675 0.609 . . . . 0.0 113.894 -177.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.816 ' HG3' ' H ' ' A' ' 68' ' ' ASN . 25.3 mt-10 72.3 61.98 0.13 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 122.245 1.022 . . . . 0.0 109.587 -176.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.771 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.4 p-10 -117.69 154.66 31.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 113.954 -1.476 . . . . 0.0 110.643 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 81.5 m -142.32 127.74 18.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.752 -173.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.657 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 16.8 m -78.9 146.67 7.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.014 0.435 . . . . 0.0 111.239 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 m -125.51 148.44 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.565 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.81 ' HG ' HD11 ' A' ' 62' ' ' LEU . 5.9 mt -83.88 106.13 15.32 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.4 p -128.54 139.61 51.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.847 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -83.42 97.35 8.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.771 174.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -137.75 139.46 40.11 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.688 -174.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 58.23 49.84 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.4 p30 53.05 18.91 1.23 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.551 1.14 . . . . 0.0 113.394 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HB3' ' NZ ' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -145.69 144.93 30.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.477 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.401 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.0 m95 -79.22 127.74 32.43 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.74 172.105 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -167.94 173.86 7.86 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.269 0.356 . . . . 0.0 110.259 174.026 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.657 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.4 m0 -84.17 119.02 24.52 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.998 0.428 . . . . 0.0 111.135 -176.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -105.76 132.39 51.94 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 166.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.771 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 8.4 t70 -85.99 123.79 31.71 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.746 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 42.1 t -132.31 140.61 38.5 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -43.19 127.91 5.48 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.92 2.413 . . . . 0.0 111.668 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 5.8 m -69.65 -6.94 34.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.529 -172.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -96.61 9.64 40.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.433 ' O ' ' HA ' ' A' ' 23' ' ' THR . 80.9 t80 -86.31 132.21 34.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.038 176.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.491 ' OE2' HG23 ' A' ' 23' ' ' THR . 8.6 mm-40 -80.11 116.6 20.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.284 175.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.453 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -142.79 -168.97 2.9 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.531 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.431 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 27.0 m -82.66 171.43 14.03 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.031 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -148.79 161.82 41.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.575 HG21 ' SD ' ' A' ' 39' ' ' MET . 4.4 mm -123.75 133.27 69.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.172 172.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 94.7 m -118.82 134.24 55.29 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.362 0.601 . . . . 0.0 110.328 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -112.18 135.95 52.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 -172.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.5 tt -139.06 142.45 33.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -64.52 166.96 16.09 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.306 2.004 . . . . 0.0 111.605 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.473 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -61.83 89.9 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.52 173.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.1 p -72.18 9.22 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 t -70.46 -15.32 62.8 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.82 -20.04 39.88 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.036 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -88.95 -46.99 8.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.228 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.8 26.11 2.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.886 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.19 -48.93 79.25 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -174.713 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 19.2 t-20 -73.93 -30.28 62.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 0.0 110.397 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.88 -45.11 90.87 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -74.63 -21.54 59.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.734 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -70.85 -34.67 71.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.056 0.455 . . . . 0.0 110.241 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -86.7 -6.25 58.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.747 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.211 -175.842 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.618 ' HB2' HG21 ' A' ' 131' ' ' THR . 62.9 mtt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.9 m -142.78 138.56 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.152 0.282 . . . . 0.0 110.562 178.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.89 121.93 39.48 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.456 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 83.3 Cg_exo -48.37 143.98 14.24 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.063 2.509 . . . . 0.0 112.728 -177.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 27.9 pt -71.69 -11.56 15.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.34 -172.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.66 -18.95 39.24 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.598 ' HH2' ' HG3' ' A' ' 34' ' ' MET . 16.2 m0 -66.32 162.81 19.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.526 177.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.7 tpp180 -90.3 110.87 21.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.992 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.717 ' HB1' HD21 ' A' ' 133' ' ' LEU . . . -93.26 121.42 34.61 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.567 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 88.0 t80 -136.45 133.97 37.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.955 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.442 ' HG3' ' CE2' ' A' ' 10' ' ' PHE . 48.1 mt-30 57.48 -94.77 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.688 0.618 . . . . 0.0 110.77 -174.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.0 p -141.03 27.72 1.95 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -131.57 160.41 35.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.715 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.61 ' HB2' HG23 ' A' ' 128' ' ' ILE . 7.8 m -117.59 127.36 53.89 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.567 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 22.4 m-85 -117.3 145.83 43.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.55 -174.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.503 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 5.8 t80 -136.41 115.2 10.68 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.305 176.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 4.8 Cg_endo -88.19 117.39 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.385 2.723 . . . . 0.0 111.828 177.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.589 ' HG ' ' NH2' ' A' ' 124' ' ' ARG . 3.5 mm? -95.23 142.13 28.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.422 -178.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 p -110.58 4.51 20.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -81.67 168.51 18.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.354 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.441 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 3.1 p-10 -104.37 129.54 52.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.751 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.586 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 14.4 mmmm -156.17 141.32 17.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.633 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 34.6 p -57.35 160.98 3.61 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 173.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.537 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 52.9 t90 -56.6 -44.13 80.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -55.23 -47.38 75.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.408 177.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.586 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 38.5 mm-40 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.698 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 124' ' ' ARG . 49.5 m -59.25 -48.0 83.26 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.715 0.293 . . . . 0.0 110.66 173.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 36.0 tt0 -56.83 -44.16 81.79 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.797 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 78.0 mtt180 -75.54 -35.11 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.595 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -72.14 -28.72 63.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.442 -170.885 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 32' ' ' SER . 18.6 m -97.97 127.03 43.66 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 166.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 58.3 p 166.13 -60.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.303 0.377 . . . . 0.0 110.448 -174.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.08 -25.38 59.69 Favored Glycine 0 C--N 1.331 0.283 0 CA-C-N 115.384 -0.826 . . . . 0.0 113.36 -176.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.598 ' HG3' ' HH2' ' A' ' 7' ' ' TRP . 0.9 OUTLIER -86.56 15.46 5.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.8 0.333 . . . . 0.0 110.591 178.409 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.22 23.3 63.57 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.613 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -124.62 -179.09 4.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.361 0.6 . . . . 0.0 111.822 -172.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -137.16 169.12 18.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.521 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 30.4 tp -60.96 128.38 36.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 168.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.658 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 24.6 ttt -47.35 112.26 0.51 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -167.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 p -93.0 110.54 22.01 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.242 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.564 HD13 ' CE ' ' A' ' 39' ' ' MET . 16.5 mm -55.12 106.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 109.523 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -88.47 -38.37 15.06 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.627 -174.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 16.3 p -137.8 154.68 49.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.061 0.458 . . . . 0.0 110.866 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.93 -32.93 74.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.849 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -74.01 -34.69 64.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.729 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB3' ' O ' ' A' ' 43' ' ' THR . 37.0 tt0 -54.98 -50.16 69.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.109 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.535 ' O ' HG23 ' A' ' 51' ' ' ILE . 5.3 tt0 -63.02 -47.32 83.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.736 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.849 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.8 p30 -68.43 -28.13 66.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.772 0.32 . . . . 0.0 111.356 -174.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -88.54 -17.78 29.52 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 47' ' ' GLN . 10.2 tp -87.45 -28.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 118.679 0.672 . . . . 0.0 111.09 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.696 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.7 pt -69.9 -11.16 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -87.29 -18.32 30.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.734 0.302 . . . . 0.0 110.672 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -91.65 -22.09 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 109.658 177.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 90.8 mt -74.91 145.33 42.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.458 178.211 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 12.2 t70 -74.72 117.4 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.499 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 43.2 mtt180 -68.98 57.95 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.471 0.482 . . . . 0.0 111.759 -178.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 2.9 ttp180 -158.2 -33.5 0.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 55' ' ' ASP . 2.9 mm? -92.53 167.64 11.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.386 0.612 . . . . 0.0 111.672 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.791 ' HB3' HG21 ' A' ' 103' ' ' VAL . 1.4 m -112.88 118.87 36.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.847 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.403 ' C ' HG23 ' A' ' 103' ' ' VAL . 92.4 m-85 -107.84 121.03 43.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.235 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.536 ' CE2' ' HB3' ' A' ' 122' ' ' ALA . 26.7 m-85 -71.97 144.96 48.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.693 0.283 . . . . 0.0 111.149 177.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.651 HD13 HD23 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -133.2 176.59 8.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 174.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.509 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -79.74 62.51 4.14 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 115.067 0.787 . . . . 0.0 115.067 -167.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.651 HD23 HD13 ' A' ' 62' ' ' LEU . 3.5 mm? -115.12 104.61 12.03 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 166.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.523 ' HB2' HG12 ' A' ' 76' ' ' VAL . 3.3 ttm-85 -93.82 116.91 29.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.197 0.522 . . . . 0.0 111.925 -169.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.701 ' HB3' ' HB2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -134.13 85.77 2.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.381 175.505 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -87.72 31.28 0.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.978 0.894 . . . . 0.0 108.817 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.677 ' HB3' ' HZ2' ' A' ' 70' ' ' LYS . 65.2 t30 179.05 137.17 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -168.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.474 ' HB2' ' H ' ' A' ' 98' ' ' GLY . . . -62.51 87.51 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 120.946 0.403 . . . . 0.0 110.152 170.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HZ2' ' HB3' ' A' ' 68' ' ' ASN . 2.2 ptpp? -126.33 118.91 26.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.821 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.01 54.03 2.19 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.969 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.592 ' HG2' ' HB2' ' A' ' 70' ' ' LYS . 9.8 pt20 -154.26 44.68 0.55 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.684 ' CH2' ' HB3' ' A' ' 100' ' ' ASN . 77.4 m95 -37.11 117.0 0.49 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.5 1.125 . . . . 0.0 112.449 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -117.39 156.89 27.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.068 0.461 . . . . 0.0 111.097 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.509 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 42.1 m95 -86.84 153.37 21.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.674 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 ' HB2' ' A' ' 65' ' ' ARG . 34.7 m -73.33 -6.94 8.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -173.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -129.54 81.75 2.04 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.369 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 68.29 -56.45 0.5 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.273 1.029 . . . . 0.0 113.117 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.492 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 18.2 m -44.23 120.16 3.64 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 79' ' ' THR . 33.1 Cg_endo -66.91 169.64 14.42 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.361 2.708 . . . . 0.0 111.957 170.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -54.25 137.62 40.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.721 -177.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -91.09 108.23 26.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.08 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.84 -24.02 25.21 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 113.071 -176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -95.4 -27.39 15.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.778 0.323 . . . . 0.0 111.361 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -112.4 83.72 1.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.167 0.508 . . . . 0.0 111.487 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 t -124.22 100.92 8.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.14 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -98.28 92.34 5.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.677 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -96.09 173.79 7.24 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.517 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 79.8 m-70 -83.62 -48.44 10.2 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.081 176.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -155.48 -41.03 0.08 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.968 171.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -171.37 65.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.514 ' OE1' ' HB2' ' A' ' 89' ' ' HIS . 22.9 mp0 -123.93 77.55 58.16 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.724 -178.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -94.94 -149.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.106 2.537 . . . . 0.0 111.877 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.41 120.91 3.09 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.763 0.664 . . . . 0.0 110.552 174.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.439 ' HB3' ' CG ' ' A' ' 115' ' ' ASP . 3.3 t30 -133.81 -50.04 0.83 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.521 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.6 t -80.9 82.45 6.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.069 0.461 . . . . 0.0 109.939 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -61.86 102.12 0.25 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.96 0.886 . . . . 0.0 111.963 -174.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.474 ' H ' ' HB2' ' A' ' 69' ' ' ALA . . . 154.54 -59.42 0.39 Allowed Glycine 0 C--N 1.314 -0.683 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.59 ' OE2' ' HB2' ' A' ' 118' ' ' CYS . 41.6 mt-10 -105.12 -148.81 0.41 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.701 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 5.1 m-20 -165.64 -91.85 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 169.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.709 ' HB2' ' O ' ' A' ' 116' ' ' VAL . 2.3 m 66.8 116.46 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 O-C-N 124.01 0.819 . . . . 0.0 111.6 168.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.63 HG13 ' CH2' ' A' ' 73' ' ' TRP . 4.7 m -107.16 144.98 15.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.645 0.736 . . . . 0.0 112.694 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.791 HG21 ' HB3' ' A' ' 59' ' ' SER . 2.2 p -111.43 148.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.394 175.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HG ' ' CD2' ' A' ' 62' ' ' LEU . 12.0 mt -82.29 101.65 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 164.182 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.21 150.21 25.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 -175.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -81.35 115.16 20.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.061 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 40.2 t30 -162.1 129.85 3.99 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.429 ' C ' ' H ' ' A' ' 110' ' ' LYS . 64.8 mt-30 69.09 35.9 2.61 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -173.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.5 t70 71.31 -25.46 0.17 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.802 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' A' ' 108' ' ' GLN . 21.3 pttm -101.2 146.75 27.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.504 0.669 . . . . 0.0 111.15 -173.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.696 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 69.3 m95 -81.91 130.86 35.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.423 172.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -156.17 167.17 31.26 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.567 ' HA ' ' O ' ' A' ' 103' ' ' VAL . 42.0 m0 -71.74 143.59 49.56 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.667 0.605 . . . . 0.0 110.78 -176.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 3.9 t30 -140.52 147.47 39.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.39 174.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.439 ' CG ' ' HB3' ' A' ' 95' ' ' ASN . 5.3 t70 -66.92 124.64 23.56 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.387 0.429 . . . . 0.0 111.039 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.709 ' O ' ' HB2' ' A' ' 101' ' ' CYS . 3.5 m -154.89 116.46 2.42 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.694 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.17 147.59 8.1 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.8 2.333 . . . . 0.0 112.777 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.596 ' O ' ' HB ' ' A' ' 23' ' ' THR . 33.5 m -70.22 -11.52 60.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.65 0.262 . . . . 0.0 111.023 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -89.97 6.61 41.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.633 ' O ' ' HA ' ' A' ' 23' ' ' THR . 79.0 t80 -93.99 133.26 37.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.487 ' OE2' HG23 ' A' ' 23' ' ' THR . 7.8 mm-40 -83.67 134.24 34.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.047 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.536 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -159.47 -170.2 2.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.351 174.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 30.0 m -81.0 164.82 22.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.793 -177.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.589 ' NH2' ' HG ' ' A' ' 18' ' ' LEU . 42.1 mtm105 -127.86 161.72 28.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.137 0.494 . . . . 0.0 111.913 -170.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 19.5 mt -134.3 125.25 47.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 57.7 m -102.66 129.69 49.33 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.658 ' HB3' ' HA ' ' A' ' 39' ' ' MET . 1.1 tppp? -114.85 122.55 46.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.007 0.432 . . . . 0.0 110.838 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 14' ' ' CYS . 8.3 tt -129.34 140.94 40.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.024 174.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.462 ' HD2' HG13 ' A' ' 128' ' ' ILE . 19.7 Cg_endo -59.16 153.26 53.79 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.265 1.976 . . . . 0.0 111.914 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -74.35 57.81 2.41 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.073 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.618 HG21 ' HB2' ' A' ' 1' ' ' MET . 2.9 t -60.3 -35.32 75.31 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 122.736 0.415 . . . . 0.0 111.132 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.4 p -94.85 2.16 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.957 0.408 . . . . 0.0 111.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.717 HD21 ' HB1' ' A' ' 9' ' ' ALA . 10.5 mp -90.16 -31.38 17.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -87.29 -55.63 3.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.178 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 139' ' ' TYR . . . -90.14 40.06 0.99 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.436 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -50.2 72.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -175.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -80.1 -31.15 39.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.226 0.536 . . . . 0.0 110.285 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.41 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 2.3 tm? -61.24 -44.41 97.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.281 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 135' ' ' ALA . 0.2 OUTLIER -76.09 -25.09 55.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.989 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -67.47 -31.2 71.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -86.92 -5.43 59.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.123 -177.263 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.439 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.485 1.279 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.442 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 18.9 m -138.14 162.89 30.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.483 ' SG ' ' HA2' ' A' ' 130' ' ' GLY . 13.3 m -113.88 93.06 27.65 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-O 121.01 0.433 . . . . 0.0 110.216 -179.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 4.6 Cg_endo -86.51 163.02 9.53 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.554 2.836 . . . . 0.0 113.881 -176.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.1 mt 56.88 -98.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.572 171.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -118.93 15.46 13.38 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.537 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 79.0 m95 -68.63 105.09 2.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 30.3 mmt180 -73.35 114.46 11.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.896 -173.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.76 121.73 28.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.766 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.465 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 87.5 t80 -129.93 102.67 6.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.878 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 66.76 -70.7 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.568 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -142.35 -11.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.119 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -100.33 159.06 15.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.9 0.381 . . . . 0.0 111.487 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 73.4 m -133.69 127.95 33.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.668 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.466 ' OH ' ' HG3' ' A' ' 46' ' ' GLU . 13.2 m-85 -121.37 137.75 54.56 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.738 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 33.4 t80 -124.26 114.93 27.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.711 0.291 . . . . 0.0 110.357 176.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 19.2 Cg_endo -89.53 128.13 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 123.346 2.698 . . . . 0.0 112.429 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.572 HD22 ' NH2' ' A' ' 124' ' ' ARG . 4.1 mp -119.36 139.18 52.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.5 p -107.76 19.97 19.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -93.17 138.31 31.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.92 0.39 . . . . 0.0 110.867 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -56.38 115.56 2.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.719 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.491 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -156.11 141.1 17.27 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.904 0.383 . . . . 0.0 110.896 -174.142 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' HG3' ' A' ' 26' ' ' GLU . 77.7 p -81.65 158.46 24.29 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 54.6 t90 -57.17 -45.05 84.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.917 0.389 . . . . 0.0 110.634 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.17 91.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.177 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.545 ' HG2' ' NH1' ' A' ' 29' ' ' ARG . 47.3 mt-10 -72.46 -35.41 68.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.221 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.591 ' HB3' ' HD3' ' A' ' 124' ' ' ARG . 67.3 m -52.3 -51.28 59.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.03 175.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.428 ' CD ' ' HD1' ' A' ' 37' ' ' HIS . 9.8 tp10 -76.69 -21.08 55.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.605 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.545 ' NH1' ' HG2' ' A' ' 26' ' ' GLU . 53.1 ttp180 -68.4 -37.41 80.33 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.079 0.466 . . . . 0.0 110.762 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -81.15 -37.27 29.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.519 0.676 . . . . 0.0 110.035 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 32' ' ' SER . 86.6 m -85.47 179.91 7.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.631 175.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.688 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 27.6 t 79.62 -43.65 0.29 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 122.715 0.406 . . . . 0.0 110.643 -177.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.94 -20.07 64.11 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.325 175.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.3 mtm -92.15 9.22 34.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 0.0 110.343 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.13 51.03 7.11 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -172.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.688 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -144.56 -178.35 5.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.936 0.398 . . . . 0.0 111.446 -170.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.428 ' HD1' ' CD ' ' A' ' 28' ' ' GLU . 2.9 m-70 -159.46 166.84 30.1 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 169.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.92 158.4 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.589 174.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.408 ' SD ' ' HD1' ' A' ' 15' ' ' TYR . 65.3 mmm -46.51 104.19 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -174.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.474 ' HA ' ' CZ3' ' A' ' 75' ' ' TRP . 18.9 p -98.72 93.28 6.0 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.498 0.665 . . . . 0.0 109.388 169.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.5 mt -76.01 122.47 30.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.158 -173.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.0 m -107.86 -27.29 10.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.874 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.1 p -134.53 155.74 49.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.619 0.723 . . . . 0.0 112.241 -176.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -65.67 -37.96 87.96 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.623 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.702 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -69.33 -37.85 77.91 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.466 ' HG3' ' OH ' ' A' ' 15' ' ' TYR . 67.1 tt0 -53.72 -50.62 65.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.584 0.707 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.432 ' O ' HG23 ' A' ' 51' ' ' ILE . 0.0 OUTLIER -64.14 -48.67 75.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.008 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.702 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.0 OUTLIER -68.12 -27.27 66.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.025 -175.529 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.611 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 3.2 m-85 -80.6 -32.48 36.41 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 178.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.56 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 8.9 tp -78.51 -30.47 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.527 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 40.9 pt -71.17 -9.69 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 20.6 pt20 -87.48 -13.44 43.14 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.382 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.63 -23.6 17.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.2 0.524 . . . . 0.0 109.639 174.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.9 mt -74.31 150.17 40.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.594 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' A' ' 57' ' ' ARG . 45.1 t0 -80.43 127.43 32.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.641 178.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.582 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 75.1 mtt180 -80.28 30.17 0.28 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -167.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.57 ' HG2' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -139.38 -1.2 1.72 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.779 169.411 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mp -100.74 157.7 16.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.13 0.49 . . . . 0.0 111.397 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.72 ' HB3' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -109.81 117.3 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.427 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 83.6 m-85 -108.77 121.46 45.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.522 0.201 . . . . 0.0 111.201 -176.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -64.99 141.82 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.186 0.517 . . . . 0.0 112.103 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.648 HD11 ' HG ' ' A' ' 104' ' ' LEU . 65.0 mt -107.06 158.73 16.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.152 175.135 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.58 49.98 4.15 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.217 -174.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.618 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 40.2 tp -131.59 124.07 29.24 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.8 ptm85 -133.99 154.37 51.16 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.748 0.785 . . . . 0.0 112.493 -174.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -112.17 152.52 28.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.216 -1.356 . . . . 0.0 107.359 166.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.591 ' HB3' ' HD2' ' A' ' 70' ' ' LYS . 4.2 tp10 -109.41 104.56 13.67 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.881 -172.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 93.5 m-20 72.26 -66.74 0.29 Allowed 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.745 0.653 . . . . 0.0 110.798 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -179.82 80.26 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 123.75 0.82 . . . . 0.0 108.828 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.612 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 17.1 mtpp -101.51 -61.6 1.36 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.329 -174.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 115.53 -21.84 12.44 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.612 ' OE1' ' HB3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -113.96 107.23 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.687 0.756 . . . . 0.0 110.309 177.027 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.618 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 25.7 m95 -76.15 150.9 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.951 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 143.52 46.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 176.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.474 ' CZ3' ' HA ' ' A' ' 40' ' ' THR . 98.7 m95 -74.98 161.72 29.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.7 p -75.96 -6.57 8.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.384 0.611 . . . . 0.0 111.396 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 15.4 p30 -109.0 21.24 17.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.284 175.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 57.8 tp60 79.29 -8.18 1.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.146 174.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 36.1 m -58.84 124.34 72.87 Favored Pre-proline 0 C--N 1.323 -0.569 0 O-C-N 122.06 -0.4 . . . . 0.0 110.525 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 32.2 Cg_exo -62.54 149.57 90.58 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.534 2.156 . . . . 0.0 111.763 175.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.447 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 76.2 t80 -59.92 122.63 14.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.0 111.756 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.474 ' ND2' ' HB3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -82.19 106.76 7.0 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.49 174.349 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -63.7 -53.27 1.39 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.085 2.523 . . . . 0.0 112.484 -176.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -89.83 34.41 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.975 0.416 . . . . 0.0 111.305 -177.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 82' ' ' ASN . 12.2 tpt180 -140.43 21.73 2.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.215 0.531 . . . . 0.0 109.623 176.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.537 HG23 ' CE3' ' A' ' 113' ' ' TRP . 11.0 p -107.04 148.8 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.11 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -129.0 74.74 1.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.25 -0.18 . . . . 0.0 110.692 -177.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.69 174.25 5.29 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.023 0.439 . . . . 0.0 111.102 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.643 ' CE1' ' HB2' ' A' ' 107' ' ' ASN . 54.5 m-70 -83.8 -60.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.688 0.28 . . . . 0.0 110.854 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -131.07 -68.74 0.66 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.752 0.786 . . . . 0.0 109.707 -175.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 p30 179.65 52.49 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.395 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 93' ' ' PRO . 1.2 mp0 -46.85 114.15 2.68 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.85 -172.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 2.9 Cg_exo -76.26 177.91 8.17 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 123.496 2.797 . . . . 0.0 112.942 -175.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -73.37 90.45 1.67 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.405 178.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -111.31 -39.62 4.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.156 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.542 ' HB2' ' ND2' ' A' ' 100' ' ' ASN . 4.2 m -85.27 117.49 24.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.918 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -123.74 88.04 2.84 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 146.53 89.69 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 10.1 pt-20 43.17 92.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.409 1.084 . . . . 0.0 111.837 -174.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.542 ' ND2' ' HB2' ' A' ' 96' ' ' SER . 2.1 m-20 -86.02 139.48 31.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.312 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 56.2 m -136.15 143.27 44.4 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.941 0.401 . . . . 0.0 109.981 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 62' ' ' LEU . 12.1 p -95.04 145.06 8.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.256 0.55 . . . . 0.0 111.841 -171.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 59' ' ' SER . 1.0 OUTLIER -126.95 142.5 43.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.353 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.648 ' HG ' HD11 ' A' ' 62' ' ' LEU . 11.3 mt -83.64 109.44 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 167.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.43 148.28 31.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.609 -176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.582 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 10.2 t80 -87.75 96.09 10.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.095 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.643 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 91.8 m-20 -131.48 144.04 50.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 65.89 24.73 11.23 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.62 0.575 . . . . 0.0 109.634 -176.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.64 22.94 12.73 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.833 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -137.08 148.3 46.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.025 0.44 . . . . 0.0 110.65 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.527 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 81.5 m95 -79.66 124.38 28.5 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.493 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -158.27 167.19 30.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.898 0.38 . . . . 0.0 111.096 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.537 ' CE3' HG23 ' A' ' 86' ' ' VAL . 7.6 m0 -78.55 138.75 38.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.969 -176.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -134.64 144.82 48.08 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -86.27 124.86 33.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.866 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.6 m -141.26 158.78 63.32 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.41 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 14.2 Cg_endo -58.1 133.17 53.72 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.406 2.071 . . . . 0.0 111.011 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 99' ' ' GLU . 3.8 t -72.52 -16.99 61.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.992 0.425 . . . . 0.0 111.245 -173.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -89.95 4.6 49.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.009 0.433 . . . . 0.0 110.185 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.516 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 63.3 t80 -81.2 151.01 28.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -102.93 142.34 34.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.23 0.538 . . . . 0.0 110.995 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.91 -167.62 1.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.26 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 26.4 m -78.91 170.99 15.82 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.141 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.591 ' HD3' ' HB3' ' A' ' 27' ' ' SER . 4.2 ttp180 -144.84 145.57 31.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -168.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.668 HG13 ' HB3' ' A' ' 60' ' ' TYR . 9.6 mt -128.4 125.29 63.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 89.8 m -113.04 146.58 38.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.037 0.446 . . . . 0.0 110.512 177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -121.12 132.92 55.15 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.304 -170.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 36' ' ' ALA . 29.3 mt -128.59 141.06 40.27 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.979 176.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.582 ' HB2' HG23 ' A' ' 131' ' ' THR . 13.4 Cg_exo -65.87 133.59 34.29 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.325 1.35 . . . . 0.0 110.251 169.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.483 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -48.24 -55.93 9.84 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 121.224 -0.512 . . . . 0.0 112.105 -177.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.582 HG23 ' HB2' ' A' ' 129' ' ' PRO . 48.0 p 61.93 -31.76 0.08 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.078 1.351 . . . . 0.0 113.849 176.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 130' ' ' GLY . 10.3 t -63.12 -21.83 66.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.462 0.305 . . . . 0.0 111.045 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 133' ' ' LEU . 2.8 mm? -56.37 -21.23 23.44 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.627 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -87.39 -41.68 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.101 0.477 . . . . 0.0 110.195 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.79 16.95 8.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.271 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -55.49 -52.43 63.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.002 0.429 . . . . 0.0 111.246 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -73.77 -27.66 61.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.476 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -63.2 -47.99 80.22 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.645 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 53.2 t80 -75.12 -24.31 58.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.332 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -65.79 -26.56 67.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.347 0.594 . . . . 0.0 109.979 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.71 -32.79 25.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.423 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' SER . . . . . 0.645 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 96.7 p . . . . . 0 C--O 1.252 1.23 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.577 -170.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.72 ' HG3' ' HA ' ' A' ' 12' ' ' SER . 77.2 mtm . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.418 ' H ' ' HB3' ' A' ' 1' ' ' MET . 7.4 p -69.57 119.57 15.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.433 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 76.2 m -147.16 171.04 6.81 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.557 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 66.2 Cg_exo -53.07 154.15 14.24 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.356 2.037 . . . . 0.0 112.417 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.6 tp -70.47 -17.39 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.092 -171.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -83.16 -23.85 32.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.863 0.363 . . . . 0.0 110.841 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.557 ' HD1' ' HB2' ' A' ' 4' ' ' PRO . 37.2 m95 -82.1 154.86 25.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.027 0.442 . . . . 0.0 110.258 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 34.9 mmt-85 -108.61 118.13 35.97 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.119 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.46 133.05 35.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.974 -174.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.482 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.1 t80 -129.15 102.24 6.38 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 58.31 -97.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.777 -176.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.72 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 9.9 p -93.63 -38.43 11.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.92 -178.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -82.56 168.45 17.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.537 -172.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 72.0 m -146.71 129.46 16.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.579 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.511 ' CE2' ' HE3' ' A' ' 127' ' ' LYS . 5.0 m-85 -120.93 141.91 50.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.578 0.228 . . . . 0.0 110.994 -173.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.42 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 47.4 t80 -128.69 118.23 19.85 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.018 176.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -84.69 120.16 2.34 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.672 2.248 . . . . 0.0 112.07 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.635 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.1 mp -109.08 139.83 43.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.996 0.427 . . . . 0.0 110.188 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.9 p -106.3 13.37 28.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.479 -177.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 12.4 p-10 -79.35 126.24 30.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.57 ' HB2' ' HB3' ' A' ' 121' ' ' GLU . 5.4 p-10 -70.59 104.45 2.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.73 0.776 . . . . 0.0 110.692 -177.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 22' ' ' LYS . 64.3 mmtt -135.71 156.71 48.4 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.217 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.0 p -77.67 171.55 14.77 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.371 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -60.07 -40.25 88.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.194 0.521 . . . . 0.0 109.996 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.7 -48.77 75.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.244 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.667 ' HG2' HH11 ' A' ' 29' ' ' ARG . 19.7 mt-10 -68.2 -34.97 77.25 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.283 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.443 ' HB3' HD11 ' A' ' 38' ' ' LEU . 67.9 m -53.17 -50.46 64.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.008 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HG2' HD13 ' A' ' 38' ' ' LEU . 9.5 mm-40 -72.1 -22.23 61.38 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.724 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.667 HH11 ' HG2' ' A' ' 26' ' ' GLU . 51.1 mtp180 -69.03 -35.53 76.74 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.767 0.318 . . . . 0.0 111.273 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -80.51 -28.52 37.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.556 0.693 . . . . 0.0 109.747 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 93.4 m -85.42 178.61 7.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.473 173.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 t 74.96 -50.65 0.67 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.819 0.447 . . . . 0.0 110.954 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.15 -25.12 69.37 Favored Glycine 0 C--O 1.227 -0.293 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.151 178.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.3 mtm -91.89 6.08 47.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.579 0.228 . . . . 0.0 110.619 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.33 -1.18 87.98 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.64 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.82 -176.75 3.67 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.708 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.17 163.1 40.01 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 176.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 28' ' ' GLU . 5.2 mp -56.16 144.66 28.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.04 0.448 . . . . 0.0 111.528 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.441 ' HA ' ' HD2' ' A' ' 127' ' ' LYS . 14.2 tpt -53.43 113.37 1.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.656 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.429 ' H ' ' CD ' ' A' ' 127' ' ' LYS . 38.6 p -104.62 135.95 45.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.059 171.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.8 mt -105.61 116.79 50.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.159 0.504 . . . . 0.0 110.716 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -97.63 -40.58 8.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.233 -178.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.6 p -135.02 167.23 21.32 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.2 0.524 . . . . 0.0 111.378 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -70.66 -34.71 72.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.845 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -64.08 -46.62 83.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.384 178.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -54.98 -47.77 74.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.092 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 51' ' ' ILE . 35.0 tt0 -59.79 -56.37 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.044 176.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 12.6 m-80 -53.82 -42.19 68.15 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.197 -176.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.436 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 22.6 m-85 -67.19 -44.9 78.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.2 tp -75.52 -32.14 24.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.828 -174.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.577 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.1 pt -70.45 -7.09 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 110.981 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 98.6 mt-30 -87.13 -23.13 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.678 174.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -89.28 -21.49 23.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.093 0.473 . . . . 0.0 110.156 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 71.2 mt -78.05 145.03 36.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.126 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.424 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.8 t70 -77.65 127.85 33.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.563 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.1 mtt180 -75.86 24.67 0.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -171.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.811 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.9 ptp180 -124.38 -15.75 6.58 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.075 175.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.811 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.4 mm? -95.7 161.99 13.8 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.278 0.561 . . . . 0.0 111.624 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.5 m -118.29 117.08 28.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.225 175.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.728 ' HB3' HG13 ' A' ' 125' ' ' ILE . 87.0 m-85 -102.09 124.86 48.43 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -169.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.493 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -58.85 135.73 57.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.843 0.354 . . . . 0.0 111.812 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.454 HD11 HD13 ' A' ' 104' ' ' LEU . 68.0 mt -115.85 175.0 5.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.272 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.61 -15.91 80.96 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.918 -0.658 . . . . 0.0 114.176 -174.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.574 HD11 ' HB3' ' A' ' 73' ' ' TRP . 47.6 tp -71.08 120.26 16.4 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.956 0.878 . . . . 0.0 110.88 -172.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -116.79 137.82 51.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.956 -174.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.542 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 6.6 t70 -113.21 139.02 49.13 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 158.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 26.0 tt0 -114.34 92.38 3.94 Favored 'General case' 0 C--N 1.31 -1.118 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.435 -173.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.547 ' HA ' ' H ' ' A' ' 99' ' ' GLU . 25.9 t-20 76.09 -63.79 0.38 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 124.311 1.007 . . . . 0.0 110.001 -176.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 179.3 77.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.424 1.078 . . . . 0.0 108.69 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 51.8 mttp -121.76 125.94 47.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.767 -176.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.54 54.55 3.68 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.301 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -154.4 66.14 0.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.363 0.602 . . . . 0.0 110.182 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.574 ' HB3' HD11 ' A' ' 64' ' ' LEU . 91.1 m95 -57.78 128.77 38.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.707 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.723 ' HD3' ' HA ' ' A' ' 78' ' ' GLN . 13.3 ttm180 -137.93 149.63 46.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.338 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.637 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 95.6 m95 -80.33 109.24 14.62 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 171.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.566 HG13 ' H ' ' A' ' 77' ' ' ASP . 2.8 p 28.25 -72.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 175.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.566 ' H ' HG13 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -78.85 -86.75 0.07 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 0.0 111.56 -173.41 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.723 ' HA ' ' HD3' ' A' ' 74' ' ' ARG . 21.6 tp60 -145.99 -1.72 0.75 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.1 0.476 . . . . 0.0 109.87 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.637 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 71.4 m -60.46 117.48 24.95 Favored Pre-proline 0 N--CA 1.452 -0.367 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.384 178.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 28.5 Cg_exo -63.85 147.11 92.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.177 2.585 . . . . 0.0 112.978 -176.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.39 147.01 52.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.472 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -83.6 124.7 75.07 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.304 -177.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.71 -2.66 12.9 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.651 2.234 . . . . 0.0 113.86 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HA ' ' HE ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -130.39 -34.53 1.6 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.79 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -83.47 82.53 8.25 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.969 0.414 . . . . 0.0 110.016 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.87 111.0 28.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.762 -178.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -121.09 91.88 3.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.022 -175.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -99.68 -178.44 3.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 110.98 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.597 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 28.6 m80 -123.53 137.57 54.74 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.574 172.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.05 12.87 3.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.855 0.836 . . . . 0.0 110.269 176.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -112.31 37.78 2.92 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.324 -1.307 . . . . 0.0 109.738 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -61.95 147.02 90.74 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.871 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.31 167.69 26.23 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.793 2.329 . . . . 0.0 112.76 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.26 -56.7 17.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.086 -179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -144.01 113.76 7.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.919 -178.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.8 p -113.08 19.17 17.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.191 0.519 . . . . 0.0 110.327 175.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -73.6 135.12 43.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.169 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.82 88.13 2.0 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -175.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.547 ' H ' ' HA ' ' A' ' 68' ' ' ASN . 1.1 mp0 44.45 84.61 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.256 0.623 . . . . 0.0 111.962 -170.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 35.1 t30 -97.23 118.62 34.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.6 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 59.2 m -120.85 132.92 55.27 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.594 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 15.5 m -88.8 141.85 13.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.291 0.567 . . . . 0.0 111.035 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 61' ' ' PHE . 27.8 m -115.67 152.65 17.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.82 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.454 HD13 HD11 ' A' ' 62' ' ' LEU . 16.7 tp -83.55 101.85 11.74 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 174.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p -118.68 142.51 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.283 0.563 . . . . 0.0 111.283 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.418 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 88.2 t80 -77.86 117.89 19.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.47 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.473 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 22.7 t-20 -151.48 116.38 5.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.467 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 66.03 46.65 2.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.402 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 74.31 -25.45 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.371 1.044 . . . . 0.0 112.231 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -106.22 146.04 30.8 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.457 0.646 . . . . 0.0 111.45 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.577 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 61.5 m95 -91.73 136.36 33.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.193 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.597 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -156.04 171.33 20.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.594 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 6.9 m0 -77.84 138.7 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.302 0.377 . . . . 0.0 110.451 -175.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -130.37 129.88 43.67 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.47 124.4 23.47 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.572 0.545 . . . . 0.0 111.417 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.4 m -146.41 157.72 48.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.86 138.46 85.85 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.026 1.817 . . . . 0.0 111.467 174.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.5 m -62.76 -20.1 64.63 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.14 0.495 . . . . 0.0 110.356 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -98.12 80.65 2.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.729 0.776 . . . . 0.0 109.11 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -155.26 110.09 2.98 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.434 -1.257 . . . . 0.0 108.232 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 21' ' ' ASN . 5.6 mp0 -63.28 110.27 1.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.102 0.477 . . . . 0.0 111.224 -175.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -140.35 -174.03 3.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.553 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.6 p -83.15 171.61 13.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.635 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -147.92 147.98 30.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.909 0.385 . . . . 0.0 111.906 -170.623 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.728 HG13 ' HB3' ' A' ' 60' ' ' TYR . 43.7 mt -117.43 131.76 69.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.3 t -117.54 133.8 55.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' A' ' 15' ' ' TYR . 21.3 ptmt -123.2 139.91 53.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.973 0.416 . . . . 0.0 110.39 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.614 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.9 tt -131.42 140.44 38.45 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 163.76 36.81 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.668 1.578 . . . . 0.0 110.749 170.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.56 ' HA3' ' HB2' ' A' ' 1' ' ' MET . . . -72.04 59.66 1.41 Allowed Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.967 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.2 t -96.52 14.76 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 23.3 m -57.7 -32.4 67.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.728 ' H ' HD12 ' A' ' 133' ' ' LEU . 2.9 mp -71.18 -43.36 67.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.162 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -67.2 -26.31 66.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.468 0.652 . . . . 0.0 110.244 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.28 25.22 1.96 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.317 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 9.2 pt-20 -54.5 -51.43 65.12 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.712 0.291 . . . . 0.0 111.401 -178.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 25.3 t-20 -74.13 -32.25 63.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -178.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.37 -46.77 88.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -69.42 -29.31 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.509 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -67.46 -23.8 65.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.706 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 77.4 mt-30 -86.72 -5.57 59.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.642 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.909 -177.566 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.5 p -159.67 155.93 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.555 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 13.8 p -150.01 170.63 7.4 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.555 ' HD2' ' HB2' ' A' ' 3' ' ' CYS . 79.4 Cg_exo -48.89 139.88 24.5 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.542 2.161 . . . . 0.0 112.313 176.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tt -72.37 89.19 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 121.946 0.879 . . . . 0.0 110.741 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -172.81 -52.48 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.283 -1.326 . . . . 0.0 108.101 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -75.19 128.42 35.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.098 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -74.33 104.22 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.15 0.5 . . . . 0.0 110.686 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . . . -70.55 134.44 47.67 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.959 177.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 74.9 t80 -144.49 124.7 13.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.573 178.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 64.0 -82.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.353 0.661 . . . . 0.0 111.392 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.0 m -146.19 6.99 1.02 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -120.77 166.67 13.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 69.9 m -122.61 126.93 48.69 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.42 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 32.6 m-85 -120.15 117.05 26.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.456 -174.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.487 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 67.5 t80 -111.66 115.64 51.15 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 0.0 110.703 178.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -85.79 122.41 2.29 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.294 2.662 . . . . 0.0 112.203 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.91 138.4 41.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.752 0.31 . . . . 0.0 110.342 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.4 p -89.03 -4.28 58.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.32 0.581 . . . . 0.0 109.907 174.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.429 ' OD2' ' HD2' ' A' ' 22' ' ' LYS . 7.1 t70 -66.2 139.97 58.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.919 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -97.28 123.69 41.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.58 -174.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.429 ' HD2' ' OD2' ' A' ' 20' ' ' ASP . 5.9 mttp -155.54 158.81 39.06 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.958 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.628 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 72.6 p -70.74 167.16 19.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 174.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.727 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.6 t90 -61.07 -35.19 76.3 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.001 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -63.62 -52.23 61.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.71 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.1 -40.5 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.565 ' HB3' HD11 ' A' ' 38' ' ' LEU . 47.6 m -58.05 -40.38 80.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.288 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.437 ' HA ' HD21 ' A' ' 38' ' ' LEU . 43.9 tt0 -74.03 -26.22 60.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.12 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.4 mtm180 -79.03 -45.1 20.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.09 0.471 . . . . 0.0 110.961 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.1 -37.87 88.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.722 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.5 m -85.57 178.9 7.23 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 171.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 24.9 m 76.85 -47.19 0.52 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.903 0.481 . . . . 0.0 111.138 -178.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.53 -20.19 67.61 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.109 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.4 mtm -93.15 6.73 46.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.699 0.285 . . . . 0.0 110.573 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.1 -5.93 69.48 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.725 -175.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.42 179.43 5.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.458 -0.371 . . . . 0.0 110.701 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.727 ' HB3' HG13 ' A' ' 76' ' ' VAL . 97.3 m-70 -147.45 169.57 19.24 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 27' ' ' SER . 3.9 mm? -59.05 154.72 15.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.865 0.302 . . . . 0.0 111.283 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.949 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.7 tpt -49.77 108.47 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.458 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.595 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 70.3 p -108.15 108.04 18.93 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.283 0.563 . . . . 0.0 110.246 177.067 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.529 HD11 HD11 ' A' ' 104' ' ' LEU . 60.9 mt -73.42 103.09 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.453 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.4 m -77.99 -48.7 15.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.06 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 55.5 p -125.42 170.15 11.67 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.85 0.833 . . . . 0.0 111.871 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -61.82 -25.84 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.55 -41.68 72.15 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.285 177.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 43' ' ' THR . 1.9 mp0 -48.25 -54.88 12.06 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.209 0.528 . . . . 0.0 109.588 171.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -59.97 4.06 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.623 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -58.55 -40.51 83.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -173.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -84.44 -36.39 22.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.25 -33.36 57.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.824 -176.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 43.0 pt -69.99 -10.33 13.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -76.01 -33.99 59.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.926 0.394 . . . . 0.0 110.0 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.89 -25.65 24.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.552 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 80.6 mt -67.94 140.2 56.43 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.662 -178.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.534 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.3 t70 -77.4 128.84 34.95 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.571 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 82.5 mtt180 -81.04 7.42 10.88 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -167.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.928 ' HG2' HD22 ' A' ' 58' ' ' LEU . 5.0 ptp180 -103.8 -13.5 16.4 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.01 176.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.928 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -101.52 150.29 23.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.059 0.457 . . . . 0.0 110.912 179.043 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.1 m -107.15 124.52 49.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.624 ' HB3' HG13 ' A' ' 125' ' ' ILE . 88.6 m-85 -105.89 122.38 46.0 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -172.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.762 ' HA ' HG12 ' A' ' 103' ' ' VAL . 21.5 m-85 -59.92 140.63 56.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.633 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' HG ' ' A' ' 104' ' ' LEU . 82.4 mt -107.68 168.22 9.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.397 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -92.84 25.48 19.15 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.148 -177.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.654 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 38.7 tp -92.87 109.03 20.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HE ' ' HH2' ' A' ' 24' ' ' TRP . 13.2 ttm180 -96.34 122.07 38.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -173.048 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -104.59 154.26 20.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 157.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' ASN . 27.8 tt0 -135.24 95.82 3.37 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.284 -174.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.741 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 18.5 m120 78.7 -45.29 0.38 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.188 175.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' ASN . . . 165.14 -6.34 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.981 -171.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 35.1 mttp -68.09 94.03 0.47 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 172.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -69.0 72.56 0.39 Allowed Glycine 0 C--N 1.329 0.162 0 O-C-N 123.649 0.593 . . . . 0.0 113.266 -176.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -125.22 74.45 1.38 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 92.1 m95 -68.19 104.88 1.93 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.303 -175.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -134.15 152.34 51.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.164 177.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.595 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 85.5 m95 -85.88 147.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 120.256 -0.578 . . . . 0.0 109.599 177.499 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.727 HG13 ' HB3' ' A' ' 37' ' ' HIS . 11.3 p -77.53 -6.76 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -167.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -100.69 -60.05 1.59 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 121.334 -0.854 . . . . 0.0 111.214 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.403 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.0 OUTLIER -170.24 -21.57 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.172 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.3 m -60.33 122.07 64.48 Favored Pre-proline 0 C--O 1.24 0.592 0 CA-C-O 121.569 0.699 . . . . 0.0 111.811 -172.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.9 Cg_exo -71.12 157.31 57.91 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.223 2.615 . . . . 0.0 111.312 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -71.89 126.14 28.98 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.466 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.507 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 19.7 m-80 -96.24 106.38 28.42 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.417 179.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.03 -29.45 40.31 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.517 2.144 . . . . 0.0 112.211 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -78.98 -22.89 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.736 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 73.0 mtt180 -117.97 31.34 6.75 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.246 -171.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 86' ' ' VAL . 7.1 p -88.78 91.6 3.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 122.116 0.96 . . . . 0.0 109.661 175.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.01 68.12 9.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.366 -169.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.421 ' CD1' HG22 ' A' ' 86' ' ' VAL . 79.0 m95 -74.23 143.8 44.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 172.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 83.6 m-70 -66.32 171.33 4.92 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 171.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.639 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -107.21 59.21 0.62 Allowed 'General case' 0 CA--C 1.5 -0.952 0 CA-C-O 122.758 1.266 . . . . 0.0 111.534 -176.353 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.421 ' HB2' ' OE1' ' A' ' 92' ' ' GLU . 2.6 m-80 -155.05 -53.67 0.09 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 111.843 -2.435 . . . . 0.0 108.316 175.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.421 ' OE1' ' HB2' ' A' ' 91' ' ' ASN . 1.9 mp0 -82.18 118.47 72.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 114.482 -1.236 . . . . 0.0 112.151 -173.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -93.66 -65.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.446 2.764 . . . . 0.0 110.666 165.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -146.94 126.75 13.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.58 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -102.3 -30.77 10.88 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.63 -178.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.4 m -159.63 92.3 1.03 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -174.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 17.9 mm-40 -77.57 85.0 3.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.56 0.695 . . . . 0.0 109.909 167.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.741 ' O ' ' HA ' ' A' ' 68' ' ' ASN . . . -125.32 -55.36 0.17 Allowed Glycine 0 CA--C 1.507 -0.459 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 176.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.673 ' HA ' ' H ' ' A' ' 68' ' ' ASN . 0.0 OUTLIER -133.48 -43.22 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 161.267 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.8 t30 69.53 123.44 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 166.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -154.83 160.7 41.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 173.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.461 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.3 m -107.65 148.02 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.17 0.509 . . . . 0.0 112.171 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.762 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -125.74 156.69 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.563 175.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.58 ' HG ' HD21 ' A' ' 62' ' ' LEU . 15.4 mt -86.53 118.39 25.92 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.3 p -134.81 143.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.601 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.4 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 34.5 t80 -80.56 105.72 12.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.754 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.424 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 48.1 t30 -156.81 140.03 15.57 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.155 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ASP . 41.9 mt-30 67.34 40.7 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.831 0.707 . . . . 0.0 109.688 -175.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 108' ' ' GLN . 31.2 t70 78.82 -16.22 0.69 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.493 174.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.75 170.79 15.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.477 0.656 . . . . 0.0 112.213 -174.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.571 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 72.2 m95 -88.07 130.63 34.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.539 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.587 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -153.04 171.1 18.91 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.409 ' HE1' HD12 ' A' ' 41' ' ' ILE . 26.7 m0 -78.01 131.88 37.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.554 0.534 . . . . 0.0 110.807 -173.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -121.17 127.95 52.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.087 174.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -82.8 125.69 31.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.254 0.549 . . . . 0.0 110.59 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.9 m -141.33 155.23 67.78 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.159 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.89 133.12 53.88 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.18 1.92 . . . . 0.0 111.246 172.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.727 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 66.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.181 -178.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -77.24 -7.77 56.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.427 . . . . 0.0 110.651 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -83.59 140.98 31.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -104.52 145.21 30.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.223 0.535 . . . . 0.0 111.33 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -159.8 -168.78 2.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.353 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.3 m -78.39 170.82 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.464 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 12.9 ptt180 -152.17 148.07 27.18 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.944 -171.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.3 mt -113.23 135.26 53.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.5 t -114.31 130.78 56.67 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -115.54 131.94 56.78 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.655 -175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.543 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.2 tt -127.54 138.5 32.96 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 175.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -64.48 166.32 17.79 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.048 1.832 . . . . 0.0 111.042 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.13 82.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.924 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 17.0 p -76.36 18.53 0.3 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 122.818 0.447 . . . . 0.0 111.797 -177.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -65.36 -14.41 60.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.106 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -69.69 -29.48 66.91 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.505 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.412 HD22 ' C ' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -73.48 -38.9 65.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.97 28.2 1.64 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.967 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 7.8 pt-20 -52.31 -51.65 57.43 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.374 0.421 . . . . 0.0 112.005 -175.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.434 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 28.7 p-10 -80.5 -27.53 37.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.653 0.264 . . . . 0.0 110.895 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.2 -49.78 70.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -73.54 -22.32 60.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -67.69 -33.1 74.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.084 0.469 . . . . 0.0 110.061 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 90.9 mt-30 -88.14 -6.17 58.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.413 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.026 -175.339 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.613 ' HG3' ' HA3' ' A' ' 130' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.575 ' HB ' ' CG2' ' A' ' 132' ' ' THR . 60.4 t -73.23 116.97 16.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.8 m -152.27 168.87 10.47 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -177.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 52.0 Cg_exo -55.13 147.36 54.55 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.016 1.811 . . . . 0.0 111.258 172.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.14 -24.93 34.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 121.182 0.515 . . . . 0.0 110.966 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -59.7 -58.22 9.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.418 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.409 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 33.4 m95 -64.71 138.7 58.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.212 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 1.7 tpp180 -86.0 106.88 17.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.092 0.472 . . . . 0.0 110.743 -176.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.25 122.54 26.44 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.38 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.453 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 65.7 t80 -140.14 119.04 12.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.563 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 56.76 -129.6 1.78 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.111 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -88.4 -4.94 58.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.706 0.289 . . . . 0.0 111.138 -178.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -105.67 169.17 8.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.136 0.493 . . . . 0.0 111.524 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.5 m -139.6 135.54 33.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.149 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 17.4 m-85 -124.43 129.64 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.932 -172.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 40.3 t80 -116.46 114.16 40.48 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.398 175.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.2 Cg_endo -88.77 130.97 2.27 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.334 2.689 . . . . 0.0 112.4 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 123' ' ' SER . 5.8 mp -107.63 140.5 40.56 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.52 60.2 1.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.398 0.618 . . . . 0.0 112.121 -171.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 1.3 t70 82.44 -168.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.292 165.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 65.1 27.44 12.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.099 -178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -141.81 141.44 33.15 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.347 0.594 . . . . 0.0 110.962 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 p -91.94 166.2 12.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.058 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.655 ' CH2' ' HG3' ' A' ' 65' ' ' ARG . 58.7 t90 -64.91 -34.78 79.22 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.3 -177.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.58 -51.88 68.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.34 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.67 -43.49 93.97 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.185 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.536 ' HB3' HD11 ' A' ' 38' ' ' LEU . 69.0 m -55.01 -46.92 75.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.468 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -68.91 -26.05 64.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.942 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -83.66 -30.24 26.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.815 0.341 . . . . 0.0 110.989 178.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.59 -42.68 19.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.569 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.4 m -101.26 128.67 47.28 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 p 154.31 -65.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.668 1.23 . . . . 0.0 108.78 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.52 -19.37 72.75 Favored Glycine 0 C--O 1.227 -0.295 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.917 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.8 mtm -78.53 1.06 23.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.751 0.31 . . . . 0.0 110.564 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.82 -11.88 63.22 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.752 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.49 161.98 13.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.576 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.449 ' HB3' HG23 ' A' ' 76' ' ' VAL . 28.3 m-70 -130.25 170.41 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 27' ' ' SER . 4.5 mm? -56.89 148.44 20.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 173.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.77 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -46.65 106.64 0.09 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.833 0.708 . . . . 0.0 112.57 -174.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.533 HG22 ' CE3' ' A' ' 75' ' ' TRP . 24.3 p -105.9 89.08 2.97 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.182 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.69 110.85 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 110.26 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.6 m -102.34 -30.8 10.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.941 -175.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 32.0 p -131.61 155.25 47.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.461 0.648 . . . . 0.0 112.309 -177.197 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -62.35 -46.78 87.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.988 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.5 -39.2 79.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 43' ' ' THR . 84.1 tt0 -52.46 -57.25 10.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.673 176.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.402 ' O ' HG23 ' A' ' 51' ' ' ILE . 57.2 tt0 -61.04 -50.91 71.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.928 179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -57.22 -31.34 65.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -88.28 -36.53 16.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.1 tp -73.1 -30.25 31.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.836 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.598 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.2 pt -71.67 -4.53 4.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.063 0.459 . . . . 0.0 110.997 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -87.85 -27.26 22.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.932 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -87.91 -22.97 24.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.642 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 73.7 mt -70.54 149.93 46.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.86 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.2 m-20 -57.73 -28.34 63.79 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.928 -177.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.649 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 60.0 mtt180 64.5 20.35 12.12 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.668 0.747 . . . . 0.0 109.273 -168.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HB3' ' HB3' ' A' ' 55' ' ' ASP . 7.3 ttp180 -120.69 -21.7 6.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.076 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -117.85 169.99 9.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.7 p -107.43 122.1 45.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.257 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -104.67 120.51 41.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 -172.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.435 ' HZ ' ' O ' ' A' ' 120' ' ' PHE . 44.7 m-85 -55.19 136.97 48.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.021 0.439 . . . . 0.0 111.851 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 104' ' ' LEU . 78.0 mt -108.21 -175.07 2.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.276 177.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.447 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -96.07 11.35 67.64 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.965 -174.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.559 ' HB3' HG22 ' A' ' 102' ' ' VAL . 28.7 tp -80.05 119.44 22.88 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.655 ' HG3' ' CH2' ' A' ' 24' ' ' TRP . 31.1 ttt-85 -111.81 126.25 54.88 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -133.75 149.95 51.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.428 -0.805 . . . . 0.0 108.945 164.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 2.4 pt-20 -148.46 119.96 7.95 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.007 0.432 . . . . 0.0 110.477 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 58.01 33.97 23.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.613 176.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.593 ' N ' ' HA2' ' A' ' 98' ' ' GLY . . . 67.99 80.79 0.2 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.744 0.653 . . . . 0.0 112.023 175.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 58.0 mttp -129.03 113.03 14.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.663 175.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.5 59.74 1.2 Allowed Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.088 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -137.59 70.28 1.4 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -61.13 108.66 0.93 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.966 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 55.1 mtm-85 -141.38 172.41 12.72 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.533 ' CE3' HG22 ' A' ' 40' ' ' THR . 97.4 m95 -86.11 173.29 9.95 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 174.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 37' ' ' HIS . 19.6 m -78.33 39.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 111.265 179.304 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 11.3 t70 -164.74 -160.16 0.49 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.441 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 22.4 tp60 -78.67 -6.44 55.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 3.5 m -74.0 120.85 83.39 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.834 -177.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 3.4 Cg_exo -78.34 155.59 28.78 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.946 2.431 . . . . 0.0 111.651 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.86 133.15 51.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.935 0.397 . . . . 0.0 110.368 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 4.1 m-20 -101.44 115.55 64.88 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.67 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.88 -9.59 25.34 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.695 2.263 . . . . 0.0 112.319 177.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.426 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.1 tpp180 -110.1 1.52 18.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.161 0.505 . . . . 0.0 110.238 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.649 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 20.2 mmt180 -128.77 57.29 1.62 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.346 0.593 . . . . 0.0 110.048 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.2 p -138.25 139.67 41.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.609 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -127.51 76.4 1.67 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.716 0.293 . . . . 0.0 110.565 -177.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -67.97 -176.05 0.64 Allowed 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.655 0.741 . . . . 0.0 112.439 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 1.2 m-70 -101.64 -154.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.478 -178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.657 ' HB2' HE22 ' A' ' 108' ' ' GLN . 72.9 mmtt -129.24 9.14 5.62 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.694 0.759 . . . . 0.0 109.369 172.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.446 ' H ' ' HB3' ' A' ' 89' ' ' HIS . 6.7 t30 -164.25 81.63 0.41 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -109.87 142.93 26.87 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.393 175.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.24 158.05 20.02 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.89 2.393 . . . . 0.0 113.28 -176.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -101.92 -2.66 29.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.759 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -57.13 -44.8 83.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.185 -172.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.433 ' HB2' ' ND2' ' A' ' 100' ' ' ASN . 0.0 OUTLIER -77.07 119.85 21.34 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.461 . . . . 0.0 111.471 -176.422 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -136.38 88.12 2.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.302 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.593 ' HA2' ' N ' ' A' ' 69' ' ' ALA . . . 123.36 111.56 2.02 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 110.606 -0.997 . . . . 0.0 110.606 -173.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.547 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 97.7 mt-10 73.07 50.05 0.15 Allowed 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -174.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.433 ' ND2' ' HB2' ' A' ' 96' ' ' SER . 12.1 m120 -86.51 106.12 17.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.455 178.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.7 m -119.87 123.25 43.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.045 0.45 . . . . 0.0 110.398 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.2 m -80.77 135.6 24.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.068 0.461 . . . . 0.0 110.526 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.7 m -115.39 147.57 18.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.826 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 28.0 tp -83.16 101.73 11.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 175.279 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.3 p -121.83 145.58 28.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 -174.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.419 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 29.7 t80 -86.08 99.41 11.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.538 177.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.3 t-20 -149.48 137.28 20.33 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.657 HE22 ' HB2' ' A' ' 90' ' ' LYS . 92.2 mt-30 69.83 24.71 5.21 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -171.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.2 t70 71.18 -11.3 0.69 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.098 -1.41 . . . . 0.0 111.637 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HZ2' ' HB2' ' A' ' 112' ' ' ALA . 14.5 ptmm? -109.04 150.67 27.45 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.0 110.304 -178.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.649 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 95.1 m95 -77.42 130.83 37.58 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.432 ' HB2' ' HZ2' ' A' ' 110' ' ' LYS . . . -152.47 156.41 39.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.823 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.554 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 17.8 m0 -81.14 115.31 20.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.37 -178.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -107.03 133.88 51.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -77.89 124.09 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.257 0.348 . . . . 0.0 111.07 -179.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.407 HG21 ' CE1' ' A' ' 120' ' ' PHE . 3.3 m -149.56 158.52 37.71 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.974 176.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.547 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 17.7 Cg_endo -60.89 137.32 71.66 Favored 'Trans proline' 0 CA--C 1.531 0.338 0 C-N-CA 122.282 1.988 . . . . 0.0 111.787 175.1 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.554 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 41.8 m -64.67 -23.85 67.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.39 15.14 18.42 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.023 -0.423 . . . . 0.0 111.169 -174.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.495 ' CZ ' ' HB2' ' A' ' 122' ' ' ALA . 0.1 OUTLIER -84.55 140.42 31.43 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.91 128.45 35.54 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.788 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.495 ' HB2' ' CZ ' ' A' ' 120' ' ' PHE . . . -161.87 -169.24 2.16 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.242 0.544 . . . . 0.0 111.261 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.544 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 14.5 m -96.6 -176.58 3.65 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.615 177.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.455 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 13.9 ptt-85 -165.41 170.08 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.045 0.45 . . . . 0.0 111.35 177.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.0 mt -122.35 135.73 61.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 6.1 t -103.43 129.16 50.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -111.95 113.08 25.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.823 -171.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.752 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.5 tt -124.85 138.78 32.04 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-O 120.867 0.365 . . . . 0.0 110.883 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -70.08 167.54 24.58 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 123.15 2.567 . . . . 0.0 111.99 170.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.613 ' HA3' ' HG3' ' A' ' 1' ' ' MET . . . -64.56 93.37 0.14 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.715 174.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.3 p -78.21 33.22 0.19 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.575 ' CG2' ' HB ' ' A' ' 2' ' ' VAL . 21.4 p -67.36 -17.13 64.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.996 0.427 . . . . 0.0 110.837 176.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 78.9 mt -73.38 -18.14 61.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.568 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -88.67 -56.52 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 110.071 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.58 29.05 1.36 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.297 -175.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -63.12 -55.81 22.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -175.788 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.45 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 5.3 p30 -80.86 -22.84 39.54 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.31 -39.48 93.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.394 177.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -81.6 -30.78 32.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.31 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -67.73 -31.2 70.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.755 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -86.76 -5.41 59.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.74 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.36 -175.657 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.517 ' HG3' ' HA ' ' A' ' 12' ' ' SER . 72.2 mtm . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.58 ' HB ' HD11 ' A' ' 133' ' ' LEU . 58.5 t -90.38 118.81 36.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.154 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 65.3 m -151.12 173.95 3.95 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 51.9 Cg_exo -53.83 148.53 37.03 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.057 1.838 . . . . 0.0 111.453 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.82 -29.93 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.925 0.393 . . . . 0.0 111.356 -172.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.09 -29.91 71.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.692 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 23.6 m95 -88.26 125.83 34.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.583 -174.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 8' ' ' ARG . 16.6 tpt180 -73.6 99.86 3.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.195 0.522 . . . . 0.0 110.063 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.37 129.46 39.83 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.86 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.435 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 85.9 t80 -132.69 105.79 7.39 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.426 177.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 56.96 -103.57 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.786 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.517 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 30.2 t -91.25 -37.94 12.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.626 -177.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -92.65 174.33 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.136 0.493 . . . . 0.0 111.729 -173.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HB2' HG22 ' A' ' 128' ' ' ILE . 78.2 m -141.2 127.5 19.79 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.407 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.435 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 53.7 m-85 -120.58 127.25 51.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.386 -171.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.8 t80 -117.94 114.66 37.17 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.781 0.324 . . . . 0.0 110.408 176.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 5.2 Cg_endo -88.11 128.01 2.22 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.247 2.631 . . . . 0.0 112.075 176.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.05 138.57 48.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.009 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 p -89.43 2.69 54.14 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.527 0.68 . . . . 0.0 109.408 173.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 22' ' ' LYS . 3.9 t70 -66.48 133.52 50.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.002 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.703 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 16.5 p-10 -93.09 107.03 18.91 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.849 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.936 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 14.4 mptt -136.83 156.08 48.96 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.833 177.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 76.4 p -76.46 167.57 21.61 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.653 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.5 t90 -58.89 -39.2 80.73 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.941 0.4 . . . . 0.0 110.771 -176.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.09 76.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.186 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.97 -34.48 77.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.044 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.9 t -58.45 -46.33 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.866 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -74.9 -22.46 58.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.76 0.314 . . . . 0.0 110.39 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -67.66 -45.81 74.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.782 0.325 . . . . 0.0 110.744 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.407 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.7 t-20 -71.97 -28.7 63.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.201 0.524 . . . . 0.0 109.949 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.52 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 65.3 m -84.13 177.13 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.41 ' HB3' ' O ' ' A' ' 31' ' ' CYS . 33.2 t 75.33 -34.82 0.26 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.017 0.527 . . . . 0.0 110.919 -177.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.67 -29.27 71.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.97 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.52 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.5 pmm? -100.47 10.51 41.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.331 . . . . 0.0 110.368 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.75 19.82 67.17 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.524 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.829 ' HB2' HG12 ' A' ' 128' ' ' ILE . . . -113.79 172.77 6.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.658 0.266 . . . . 0.0 111.39 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.468 ' HD2' ' OD1' ' A' ' 77' ' ' ASP . 71.3 m-70 -140.48 169.2 18.11 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' HG23 ' A' ' 40' ' ' THR . 4.1 mm? -52.44 141.02 20.86 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.371 0.419 . . . . 0.0 110.922 173.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.572 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.8 tpt -36.26 111.15 0.13 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.145 0.903 . . . . 0.0 112.439 177.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.647 HG21 ' HB3' ' A' ' 77' ' ' ASP . 12.0 p -111.89 89.01 2.94 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.522 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.567 ' HA ' ' OE2' ' A' ' 46' ' ' GLU . 41.9 mt -64.65 114.83 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.486 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m -106.9 -22.78 12.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.832 -177.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.597 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 13.1 p -132.96 151.9 52.0 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.362 1.077 . . . . 0.0 113.182 -178.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.96 -50.63 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.548 -179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -59.36 -39.41 83.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.542 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' ' 43' ' ' THR . 61.8 tt0 -48.5 -58.93 3.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.183 176.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.505 ' HA ' HG22 ' A' ' 50' ' ' ILE . 23.0 tt0 -61.18 -44.66 96.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.932 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -61.96 -25.42 67.6 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -177.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 27.5 m-85 -88.53 -37.81 15.42 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.3 tp -71.88 -30.01 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 120.381 -0.528 . . . . 0.0 111.103 -176.376 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.465 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.8 pt -69.44 -5.79 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.032 0.444 . . . . 0.0 111.196 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -87.22 -25.29 24.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.211 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -92.97 -23.81 18.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.494 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.7 mt -76.55 144.43 39.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.043 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.556 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -78.65 138.2 38.19 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.56 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 84.8 mtt180 -83.46 11.68 6.63 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -170.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.859 ' HG2' HD22 ' A' ' 58' ' ' LEU . 7.3 ptp180 -112.11 -11.08 13.84 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.755 176.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.859 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -100.22 166.91 10.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.271 0.558 . . . . 0.0 111.609 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.3 m -127.17 124.09 38.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.035 175.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.702 ' HB3' HG13 ' A' ' 125' ' ' ILE . 80.6 m-85 -109.07 121.95 46.23 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -169.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.463 ' HA ' HG12 ' A' ' 103' ' ' VAL . 19.1 m-85 -62.38 138.94 58.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.725 0.297 . . . . 0.0 111.791 177.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.626 HD23 HG12 ' A' ' 102' ' ' VAL . 1.4 mm? -110.92 173.36 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 174.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.641 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -87.73 60.65 4.19 Favored Glycine 0 C--O 1.225 -0.414 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.315 -177.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.461 HD23 ' HB ' ' A' ' 102' ' ' VAL . 3.3 mm? -109.55 126.42 53.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.724 0.262 . . . . 0.0 110.329 177.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.504 ' NH1' ' HB3' ' A' ' 67' ' ' GLU . 16.5 ttp85 -110.87 117.53 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.422 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -136.49 84.85 2.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.982 0.896 . . . . 0.0 108.998 164.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NH1' ' A' ' 65' ' ' ARG . 3.3 tm-20 -91.15 123.82 34.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.499 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.404 ' HB3' ' NZ ' ' A' ' 70' ' ' LYS . 3.2 t-20 71.28 19.94 5.19 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.867 0.73 . . . . 0.0 110.191 178.129 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.37 75.14 0.33 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.127 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 52.0 mttp -101.95 -22.56 14.27 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.654 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 -8.17 62.79 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.568 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -86.07 65.14 8.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.554 0.692 . . . . 0.0 110.289 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -61.16 113.82 2.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.177 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -133.32 151.01 51.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.737 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 75.4 m95 -84.61 136.96 33.55 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.439 HG21 ' CZ2' ' A' ' 24' ' ' TRP . 10.5 t -79.2 47.98 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.662 0.744 . . . . 0.0 110.809 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.647 ' HB3' HG21 ' A' ' 40' ' ' THR . 33.9 t70 -162.09 32.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -178.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? 76.76 -37.29 0.28 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.279 -1.328 . . . . 0.0 111.586 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 24.2 m -43.26 122.29 3.27 Favored Pre-proline 0 C--O 1.239 0.505 0 CA-C-O 121.531 0.681 . . . . 0.0 112.664 -176.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.8 Cg_exo -72.04 148.15 50.27 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 123.309 2.673 . . . . 0.0 111.644 174.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 75' ' ' TRP . 68.0 t80 -69.86 127.91 34.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.253 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.473 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 0.9 OUTLIER -89.65 115.98 65.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.347 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.65 -29.15 36.73 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.63 2.22 . . . . 0.0 112.651 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -90.09 -22.56 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.802 0.334 . . . . 0.0 111.249 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.473 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 86.4 mtt180 -105.92 76.91 1.21 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.512 0.673 . . . . 0.0 110.484 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.0 p -136.41 131.02 47.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.944 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -126.39 52.05 1.76 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.909 -168.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.425 ' CH2' HG22 ' A' ' 102' ' ' VAL . 85.8 m95 -64.81 177.95 0.87 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.454 0.645 . . . . 0.0 111.372 178.273 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.495 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 91.0 m-70 -79.3 126.54 30.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.536 172.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.74 ' HD3' ' H ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -58.55 108.48 0.64 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.572 0.701 . . . . 0.0 109.648 174.733 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 25.1 t-20 61.05 90.13 0.07 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.784 -167.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.436 ' HG3' ' HB2' ' A' ' 89' ' ' HIS . 28.6 tt0 -101.61 105.14 39.0 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.18 -172.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 72.2 Cg_endo -82.06 -24.98 3.63 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.468 2.112 . . . . 0.0 111.101 172.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -86.92 83.34 7.54 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.077 176.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -148.22 144.57 27.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.079 -177.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 m -121.44 163.71 18.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.821 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -135.66 124.75 24.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.352 175.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 134.75 -101.7 0.41 Allowed Glycine 0 N--CA 1.453 -0.197 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 179.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 37.4 mt-10 -88.95 66.69 7.97 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.493 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.2 p-10 -103.64 132.06 50.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.529 0.68 . . . . 0.0 111.891 -170.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.37 166.34 28.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.464 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.626 HG12 HD23 ' A' ' 62' ' ' LEU . 59.1 t -95.71 139.88 18.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -169.12 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.6 m -123.9 141.45 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.718 168.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.51 ' N ' HD21 ' A' ' 62' ' ' LEU . 13.9 tp -81.53 109.99 16.5 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.38 140.46 49.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.57 -172.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.56 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 66.5 t80 -88.25 96.09 10.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.495 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 49.5 t-20 -129.33 128.53 43.31 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -176.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 61.45 38.79 15.67 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.856 0.722 . . . . 0.0 109.987 -175.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 10.5 m-20 65.56 16.9 10.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.246 -1.343 . . . . 0.0 113.15 174.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HE2' ' HB2' ' A' ' 110' ' ' LYS . 10.9 ptmm? -132.49 137.09 47.08 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.903 172.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.465 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -70.8 130.35 41.46 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 170.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -157.0 168.81 26.38 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.471 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.404 ' HB3' HG13 ' A' ' 102' ' ' VAL . 37.0 m0 -79.15 142.16 36.61 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.292 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -136.25 122.17 20.04 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 13.5 t70 -84.17 123.6 30.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.702 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.449 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 21.3 m -139.23 159.94 64.27 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.458 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.572 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 13.1 Cg_endo -57.38 131.32 44.04 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.53 2.153 . . . . 0.0 111.942 175.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 69.5 m -67.19 -12.75 60.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.19 0.519 . . . . 0.0 110.657 177.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -85.77 -2.78 58.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.55 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.476 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 83.5 t80 -88.0 138.35 31.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.109 175.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.96 135.91 33.73 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.906 0.384 . . . . 0.0 110.252 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.441 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -154.14 -173.21 4.49 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.969 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 39.2 m -74.29 160.45 31.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.985 0.421 . . . . 0.0 110.088 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.936 ' HD2' ' HB2' ' A' ' 22' ' ' LYS . 48.4 mtp180 -127.26 145.85 50.63 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.587 -169.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.702 HG13 ' HB3' ' A' ' 60' ' ' TYR . 59.0 mt -124.65 119.63 56.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 166.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.54 132.8 53.47 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -112.91 126.54 55.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.075 0.464 . . . . 0.0 111.961 -174.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.829 HG12 ' HB2' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -111.38 134.74 21.09 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.941 175.562 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HD13 ' A' ' 128' ' ' ILE . 6.6 Cg_exo -74.11 158.63 45.35 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.113 1.875 . . . . 0.0 111.164 173.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.41 49.59 2.33 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.9 t -111.12 18.08 19.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.08 0.467 . . . . 0.0 110.521 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.2 m -60.53 -21.91 63.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.227 0.536 . . . . 0.0 111.258 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 133' ' ' LEU . 3.9 mp -75.91 -28.9 58.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.102 179.121 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -87.82 -43.17 12.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.871 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -85.79 61.13 6.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.172 -177.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -43.37 74.2 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.2 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -74.8 -30.08 61.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.563 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tt -64.91 -45.28 86.53 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.82 -30.55 71.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.278 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -71.95 -35.64 69.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.812 178.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -86.64 -6.11 58.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.998 -176.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.252 1.226 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.785 -177.618 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.4 ' CE ' ' HA ' ' A' ' 8' ' ' ARG . 3.2 ptt? . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 88.3 t -74.92 112.98 13.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-O 121.104 0.478 . . . . 0.0 111.386 -172.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.754 ' SG ' ' HD2' ' A' ' 4' ' ' PRO . 3.0 t -170.46 166.06 5.12 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 173.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.754 ' HD2' ' SG ' ' A' ' 3' ' ' CYS . 18.5 Cg_endo -64.96 119.42 6.45 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 N-CA-C 108.859 -1.247 . . . . 0.0 108.859 164.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.411 HG22 ' N ' ' A' ' 6' ' ' ASP . 5.3 mp 60.19 159.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -166.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.411 ' N ' HG22 ' A' ' 5' ' ' ILE . 10.7 t70 -79.96 72.76 6.74 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.117 -0.989 . . . . 0.0 110.394 -177.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.454 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 10.4 m0 -73.23 155.34 39.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.179 174.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 8' ' ' ARG . 18.3 tpt180 -72.87 102.07 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.067 0.461 . . . . 0.0 110.063 -177.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -87.19 124.91 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.112 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.47 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 66.9 t80 -120.36 110.98 17.18 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.177 174.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 66.88 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.101 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -149.07 17.33 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.926 0.393 . . . . 0.0 110.625 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.481 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 36.8 m-80 -125.92 151.01 47.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.463 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.758 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 80.3 m -106.25 135.03 48.45 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.325 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 27.7 m-85 -129.24 134.72 48.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.511 ' HD2' HD22 ' A' ' 18' ' ' LEU . 8.4 t80 -123.73 113.23 28.77 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.9 Cg_endo -89.68 118.35 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.533 2.822 . . . . 0.0 111.858 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -132.24 140.47 48.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.371 0.605 . . . . 0.0 110.389 178.373 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 p -86.99 5.29 38.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.299 -169.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 18' ' ' LEU . 2.8 m-20 -59.56 135.04 57.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.052 0.453 . . . . 0.0 110.174 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.676 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 2.1 p-10 -96.28 102.3 14.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.022 -176.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.676 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 13.4 mmmt -137.07 155.52 49.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 179.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.7 p -70.72 178.98 2.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.834 -176.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.559 ' CZ2' HG23 ' A' ' 76' ' ' VAL . 49.4 t90 -56.54 -52.7 63.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.12 0.486 . . . . 0.0 110.444 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.633 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -67.04 -43.72 82.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.293 -177.294 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.28 -31.54 64.13 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -174.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 p -67.26 -35.26 79.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.581 175.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' HB2' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -66.25 -30.98 71.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.739 173.975 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.633 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 11.1 mmt-85 -83.24 -25.59 31.55 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.105 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -77.61 -26.39 50.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.7 m -85.87 178.88 7.15 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 166.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.743 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 6.9 p 81.39 -41.23 0.15 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.79 0.836 . . . . 0.0 111.565 172.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.81 -23.09 58.49 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 116.202 -0.454 . . . . 0.0 113.008 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -100.62 15.73 27.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.658 0.266 . . . . 0.0 110.914 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.18 47.59 7.43 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.2 -175.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -142.98 -174.37 4.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.835 0.35 . . . . 0.0 110.649 -173.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.653 ' CD2' ' HB2' ' A' ' 77' ' ' ASP . 9.6 t60 -148.48 162.16 40.18 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 171.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 28' ' ' GLU . 21.9 tp -56.95 145.73 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.4 113.67 2.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.542 0.686 . . . . 0.0 112.443 -173.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -106.92 109.71 21.67 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.252 170.164 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.2 mt -64.6 111.68 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.975 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.1 m -97.16 -31.65 12.35 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.787 -174.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 21.9 p -128.04 153.27 46.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.85 0.833 . . . . 0.0 112.433 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.443 ' CG ' ' HG2' ' A' ' 85' ' ' ARG . 19.3 mt-10 -66.69 -36.12 81.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.965 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.11 79.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.033 0.444 . . . . 0.0 110.425 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.565 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.8 tt0 -55.58 -54.54 42.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.42 ' O ' HG23 ' A' ' 51' ' ' ILE . 21.5 tm0? -57.74 -48.86 78.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.641 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -64.02 -27.73 69.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.277 -176.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -89.23 -41.24 12.32 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.9 tp -62.51 -35.52 70.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 -176.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.65 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 41.5 pt -68.1 -9.22 10.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.497 -178.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -82.81 -30.0 29.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.24 -28.8 25.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.694 -178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 69.4 mt -62.86 158.02 20.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.505 ' OD2' ' HB3' ' A' ' 57' ' ' ARG . 15.8 t70 -78.88 -2.45 39.92 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.994 -1.003 . . . . 0.0 112.975 -171.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.719 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 10.9 mpt_? 64.94 -57.51 0.27 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -172.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HB3' ' OD2' ' A' ' 55' ' ' ASP . 13.5 ttp180 -61.99 -27.73 69.07 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 122.982 0.513 . . . . 0.0 111.864 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.51 147.32 24.04 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.367 0.603 . . . . 0.0 112.243 -175.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.9 m -100.93 130.54 46.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.72 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 123' ' ' SER . 86.2 m-85 -112.94 124.34 52.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -174.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -69.99 127.93 34.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.033 174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.562 HD21 ' HB2' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -169.71 -177.48 2.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.648 179.334 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.414 ' HA2' ' CZ3' ' A' ' 75' ' ' TRP . . . 83.77 -115.03 3.98 Favored Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 115.23 0.852 . . . . 0.0 115.23 163.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 75' ' ' TRP . 3.2 mm? -93.67 154.32 17.88 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.132 -0.534 . . . . 0.0 110.577 -170.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.456 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 14.0 ttm180 -93.6 104.33 16.45 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.72 ' HB2' ' HA ' ' A' ' 101' ' ' CYS . 5.4 m-20 -97.0 75.4 2.64 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.993 0.902 . . . . 0.0 108.778 178.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 13.8 tt0 -112.39 121.16 44.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 114.574 -1.193 . . . . 0.0 110.624 -171.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 67.86 15.87 9.61 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.469 0.48 . . . . 0.0 110.688 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.91 35.1 24.85 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.492 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 23.8 mttm -64.46 137.21 57.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.407 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -68.59 -15.32 68.38 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.064 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.95 86.0 7.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.693 ' HZ3' ' HA ' ' A' ' 66' ' ' ASP . 71.9 m95 -75.54 133.7 40.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.09 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.568 HH21 ' HA ' ' A' ' 78' ' ' GLN . 73.2 ttt180 -150.47 149.11 29.56 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.502 ' HA ' HD13 ' A' ' 64' ' ' LEU . 78.0 m95 -69.66 169.92 11.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.34 0.591 . . . . 0.0 111.01 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 40' ' ' THR . 8.8 p -62.57 -19.31 22.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.714 -178.097 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.653 ' HB2' ' CD2' ' A' ' 37' ' ' HIS . 20.5 t70 -147.67 103.57 3.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.471 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.568 ' HA ' HH21 ' A' ' 74' ' ' ARG . 45.4 tp60 64.88 -64.68 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 7.4 m -42.99 127.89 3.25 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 124.206 1.002 . . . . 0.0 112.963 -173.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.7 Cg_exo -74.89 159.68 41.44 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.087 2.525 . . . . 0.0 111.687 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -54.64 133.07 46.57 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.752 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.462 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 11.0 t-20 -103.97 128.4 27.29 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.658 -175.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.3 Cg_exo -67.92 -36.25 18.46 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.01 2.474 . . . . 0.0 113.904 -177.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 33.0 ttp180 -96.13 -34.73 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.623 -176.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.443 ' HG2' ' CG ' ' A' ' 44' ' ' GLU . 95.8 mtt180 -93.14 25.4 3.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.301 0.572 . . . . 0.0 110.814 -172.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 86' ' ' VAL . 6.0 p -90.88 95.39 5.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.978 0.894 . . . . 0.0 109.619 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.25 73.36 10.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.291 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 25.5 m95 -66.75 166.64 12.73 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.499 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 1.025 ' HB3' ' HB2' ' A' ' 92' ' ' GLU . 6.2 t-80 -100.84 56.74 0.87 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.537 -172.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt 63.27 -86.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.826 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.465 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 3.8 p-10 -103.82 5.57 36.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.384 -177.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 1.025 ' HB2' ' HB3' ' A' ' 89' ' ' HIS . 33.6 mt-10 -107.67 97.91 22.24 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.464 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 88.2 Cg_endo -98.39 -150.76 0.03 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.58 2.853 . . . . 0.0 111.529 176.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -82.99 130.71 35.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.043 0.449 . . . . 0.0 110.231 175.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -133.52 -152.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.23 -177.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.487 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 22.9 t 68.29 -163.65 0.2 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.045 175.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.69 6.3 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.486 . . . . 0.0 110.794 -176.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 167.23 -44.51 0.25 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.831 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.793 ' HB3' ' H ' ' A' ' 118' ' ' CYS . 47.4 mt-10 -97.49 95.48 7.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.677 ' HB2' ' OD2' ' A' ' 115' ' ' ASP . 6.6 p30 -131.29 25.76 4.84 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.111 0.482 . . . . 0.0 110.311 -176.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.72 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 93.2 m -46.86 131.21 11.99 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.077 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.84 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 10.4 m -80.14 144.17 11.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.582 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.647 HG11 ' HE1' ' A' ' 120' ' ' PHE . 28.0 m -130.62 150.01 34.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.787 170.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.562 ' HB2' HD21 ' A' ' 62' ' ' LEU . 14.7 tp -83.88 110.53 18.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 11.1 p -134.46 152.31 33.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 -176.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.711 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 20.0 t80 -87.61 96.85 10.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.649 177.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.586 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 57.6 t30 -133.65 145.59 50.11 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 63.89 16.06 9.57 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.432 0.457 . . . . 0.0 110.414 -176.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.8 t70 78.0 19.55 1.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.136 0.897 . . . . 0.0 111.624 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' HE3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -141.74 156.29 45.61 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.391 -0.818 . . . . 0.0 111.599 173.643 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.719 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.7 m95 -85.54 128.54 34.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.716 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -165.27 174.46 10.16 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.64 175.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.84 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 30.3 m0 -80.17 124.48 28.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.97 0.414 . . . . 0.0 111.165 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.423 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 8.0 t-20 -99.55 142.25 31.27 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.372 176.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.677 ' OD2' ' HB2' ' A' ' 100' ' ' ASN . 14.4 t70 -84.84 122.65 29.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.418 HG21 ' CE1' ' A' ' 120' ' ' PHE . 0.6 OUTLIER -151.27 149.04 23.66 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 111.54 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 120' ' ' PHE . 8.2 Cg_endo -53.01 144.84 44.06 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.883 2.389 . . . . 0.0 111.52 172.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.793 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 26.4 m -81.97 -14.41 56.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.576 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -80.4 -8.95 59.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.459 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.647 ' HE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -74.07 133.62 42.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 170.854 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -112.73 146.26 39.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.471 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.451 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.45 -168.6 3.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.365 -176.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 8.5 t -69.35 166.66 18.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.696 HH11 ' HB2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -153.35 161.84 41.91 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -168.152 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.417 HD11 HD21 ' A' ' 54' ' ' LEU . 68.1 mt -136.55 133.94 49.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.101 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 75.8 m -102.6 142.25 34.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 173.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -121.81 136.01 54.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.852 0.358 . . . . 0.0 110.807 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.758 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 56.2 mt -125.23 135.28 26.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.754 177.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.19 157.21 29.94 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.065 1.843 . . . . 0.0 111.45 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.24 58.19 1.92 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.464 179.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.0 t -69.26 -20.9 63.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 111.568 0.211 . . . . 0.0 111.568 -176.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.6 m -66.09 -26.54 67.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.142 0.496 . . . . 0.0 110.617 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.441 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.8 mp -90.32 -20.84 22.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.368 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.01 -28.46 22.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.429 0.633 . . . . 0.0 109.35 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.67 39.31 0.95 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.716 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -64.32 -49.56 71.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.851 -174.699 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -83.2 -26.8 30.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.011 0.434 . . . . 0.0 110.267 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 58.1 mt -62.54 -52.59 62.85 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.601 178.289 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -75.05 -19.3 60.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.279 0.562 . . . . 0.0 110.057 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.02 -39.71 95.56 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -87.76 -44.53 11.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.271 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.46 -177.764 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.742 ' HG3' HG21 ' A' ' 132' ' ' THR . 63.6 ttp . . . . . 0 N--CA 1.481 1.106 0 CA-C-O 120.759 0.314 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.489 HG22 ' OG1' ' A' ' 132' ' ' THR . 17.0 m -98.48 119.59 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.675 0.75 . . . . 0.0 111.951 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.2 m -147.39 141.15 15.5 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.347 171.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.446 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 41.1 Cg_exo -57.27 149.15 66.28 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.489 2.126 . . . . 0.0 112.155 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.74 -14.84 18.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.403 0.621 . . . . 0.0 111.132 -176.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.7 -30.61 67.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.262 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.553 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 23.0 m95 -90.96 161.47 15.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.015 -173.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 50.3 mmt-85 -115.7 136.19 53.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.931 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -102.91 135.83 43.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.916 0.389 . . . . 0.0 111.579 -176.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.45 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 73.6 t80 -137.97 110.18 7.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.621 175.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 66.0 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.209 -176.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.6 m -151.92 30.19 0.57 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.268 0.556 . . . . 0.0 109.759 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.471 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 17.7 m-80 -129.02 149.9 50.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.384 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 85.5 m -124.89 127.14 46.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 109.928 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.45 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 5.6 m-85 -117.0 141.59 48.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.194 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.553 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 26.4 t80 -128.74 114.9 19.25 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-O 120.73 0.3 . . . . 0.0 110.367 175.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -88.79 138.41 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.998 2.465 . . . . 0.0 112.23 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.45 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 5.1 mp -122.48 149.66 43.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.093 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 20' ' ' ASP . 2.6 p -101.16 66.29 1.12 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.886 -167.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.448 ' HA ' ' C ' ' A' ' 122' ' ' ALA . 32.0 t70 81.42 178.39 0.08 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.708 165.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 0.5 OUTLIER 86.57 15.23 0.11 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.569 1.147 . . . . 0.0 112.326 174.828 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.837 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 70.0 mmtt -139.28 148.23 42.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.95 0.405 . . . . 0.0 111.376 176.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.6 p -85.17 172.2 11.39 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 75.4 t90 -62.16 -39.96 94.37 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.09 -58.14 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.229 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.837 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 52.2 mm-40 -56.7 -37.75 71.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.538 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.556 ' HB3' HD21 ' A' ' 38' ' ' LEU . 71.7 m -54.59 -50.73 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.538 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 31' ' ' CYS . 9.0 tp10 -81.11 -21.66 39.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.737 0.303 . . . . 0.0 110.767 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 99.2 mtt180 -65.67 -42.98 90.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.074 0.464 . . . . 0.0 110.066 172.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -74.59 -28.22 60.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.226 178.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 81.4 m -84.33 178.54 7.73 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.149 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.2 m 71.78 -45.66 0.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.67 0.388 . . . . 0.0 111.077 -174.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.96 -18.39 70.66 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.2 -0.524 . . . . 0.0 111.965 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.6 mtm -97.99 3.82 49.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.329 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.9 89.45 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.89 -0.672 . . . . 0.0 111.891 -175.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -100.36 -176.58 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.722 -0.239 . . . . 0.0 110.873 -178.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -149.31 165.09 33.02 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.242 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 27' ' ' SER . 33.2 mt -60.32 144.81 49.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.069 0.461 . . . . 0.0 111.442 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.431 ' CE ' HG12 ' A' ' 41' ' ' ILE . 0.5 OUTLIER -57.79 120.02 7.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.982 -175.727 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.535 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 53.9 p -116.86 101.91 8.94 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.646 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.431 HG12 ' CE ' ' A' ' 39' ' ' MET . 39.2 mt -64.8 109.2 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.212 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 m -95.78 -37.83 10.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.462 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.9 p -125.66 154.09 42.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.545 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -68.39 -30.23 69.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.447 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.38 -47.27 86.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.198 175.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -53.18 -47.35 68.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.277 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -60.82 -53.57 55.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.15 176.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -57.81 -31.02 66.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.433 -174.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.447 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 34.1 m-85 -82.56 -39.24 22.56 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.7 tp -73.28 -32.22 36.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.576 -0.45 . . . . 0.0 111.35 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.428 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 34.6 pt -69.34 -9.07 11.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.478 . . . . 0.0 111.234 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -78.64 -27.42 45.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.161 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -91.51 -27.67 18.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.801 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.0 mt -68.95 134.32 49.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.663 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.436 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.7 t70 -61.5 128.74 37.78 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 171.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.554 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 64.9 mtt180 -85.48 32.02 0.58 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -168.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.855 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.0 ptp180 -127.03 -24.45 3.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.507 174.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.855 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -86.31 162.3 18.3 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.277 0.561 . . . . 0.0 112.074 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.434 ' HB2' HG21 ' A' ' 103' ' ' VAL . 4.6 p -112.55 112.74 24.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 174.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 125' ' ' ILE . 62.7 m-85 -99.36 120.74 40.07 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.715 ' HA ' HG12 ' A' ' 103' ' ' VAL . 24.3 m-85 -59.12 128.99 39.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.071 0.462 . . . . 0.0 111.734 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.821 HD11 ' HG ' ' A' ' 104' ' ' LEU . 98.9 mt -103.53 157.43 17.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.194 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.604 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -78.98 39.39 2.03 Favored Glycine 0 C--O 1.223 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 113.333 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.642 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.2 tp -105.04 116.35 31.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.414 0.607 . . . . 0.0 109.621 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.3 ttt85 -115.03 127.73 55.83 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -172.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -122.91 107.37 11.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.695 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.4 tt0 -99.71 118.73 36.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.679 -172.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.0 m120 69.0 21.5 7.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.431 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.94 70.07 0.68 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.687 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.695 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 61.1 mttp -91.59 -16.77 26.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.949 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.77 12.63 82.8 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -109.43 74.99 0.92 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.058 -0.571 . . . . 0.0 109.656 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.641 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.7 m95 -66.68 104.23 1.26 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 178.223 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -123.68 144.62 49.53 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 -174.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TRP . . . . . 0.604 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 89.8 m95 -85.99 131.66 34.23 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.1 p -57.82 -27.92 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.989 -175.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.515 ' HB3' HG21 ' A' ' 40' ' ' THR . 2.3 t70 -55.92 -62.43 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.039 173.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.437 ' HB2' ' O ' ' A' ' 77' ' ' ASP . 21.8 tm0? 163.44 -29.89 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.6 m -42.08 121.74 2.48 Favored Pre-proline 0 C--O 1.235 0.333 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.09 -178.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 23.7 Cg_exo -66.96 161.28 43.2 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.647 2.231 . . . . 0.0 111.385 173.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 56.5 t80 -69.02 142.46 54.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.833 -178.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.481 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 45.0 m-80 -103.1 96.84 8.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.305 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 17.7 Cg_exo -67.33 -29.85 37.75 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.519 2.146 . . . . 0.0 111.539 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -81.04 -11.66 59.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.629 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.481 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 92.2 mtt180 -129.44 55.51 1.76 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.176 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.73 138.06 27.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.924 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -130.77 71.6 1.47 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.298 -177.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -75.84 168.95 19.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.799 ' HB3' ' HB2' ' A' ' 92' ' ' GLU . 3.9 m-70 -95.02 106.59 18.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.024 173.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.464 ' HG2' ' OD1' ' A' ' 91' ' ' ASN . 88.1 tttt -62.87 130.04 43.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.669 -178.274 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.464 ' OD1' ' HG2' ' A' ' 90' ' ' LYS . 23.4 m120 70.09 16.44 7.49 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.275 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.799 ' HB2' ' HB3' ' A' ' 89' ' ' HIS . 35.4 mt-10 -125.44 121.69 24.89 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.193 172.225 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.03 115.83 3.35 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.498 2.132 . . . . 0.0 111.985 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.555 ' OD1' ' HA ' ' A' ' 114' ' ' ASN . 63.7 m-20 -110.95 81.32 1.41 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.623 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 94' ' ' ASP . 65.0 t30 176.73 101.78 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.976 177.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' ' 100' ' ' ASN . 15.6 m -86.42 15.08 5.74 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 45.35 25.83 0.24 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.791 1.237 . . . . 0.0 113.825 175.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -137.08 -143.16 4.53 Favored Glycine 0 CA--C 1.505 -0.553 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 177.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.597 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 9.4 pt-20 -88.75 86.17 6.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 118.498 1.149 . . . . 0.0 108.186 168.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.791 ' HB3' ' HB2' ' A' ' 96' ' ' SER . 1.3 p-10 -109.43 163.06 13.76 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.466 -1.243 . . . . 0.0 111.314 -172.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.11 148.24 28.06 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.306 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 64' ' ' LEU . 20.9 m -88.56 147.21 5.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.209 0.528 . . . . 0.0 111.344 -176.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.715 HG12 ' HA ' ' A' ' 61' ' ' PHE . 34.5 m -118.59 152.76 20.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.411 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.821 ' HG ' HD11 ' A' ' 62' ' ' LEU . 17.4 mt -83.09 103.41 12.5 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.01 138.34 53.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.488 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -87.71 96.52 10.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.478 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASN . . . . . 0.47 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 62.2 t30 -140.88 147.17 38.49 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 64.4 24.25 13.15 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.648 0.593 . . . . 0.0 109.705 -172.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 66.59 22.6 10.5 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.315 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -134.41 151.31 51.11 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.969 -0.457 . . . . 0.0 111.199 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TRP . . . . . 0.554 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 81.9 m95 -88.71 108.6 19.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.509 171.204 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -143.45 165.76 26.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.93 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.582 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.3 m0 -78.0 125.67 29.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.39 -177.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.555 ' HA ' ' OD1' ' A' ' 94' ' ' ASP . 2.7 t-20 -121.99 125.7 46.9 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 172.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 20.0 t70 -84.17 128.08 34.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.213 0.53 . . . . 0.0 111.744 -173.895 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.59 159.03 69.21 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.552 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.57 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.4 Cg_endo -55.85 137.93 80.23 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.384 2.056 . . . . 0.0 111.929 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 90.1 m -69.74 -9.1 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -178.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -98.85 13.24 33.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.627 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.57 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 61.9 t80 -89.08 140.36 29.53 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.611 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -82.57 125.13 30.81 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 177.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.569 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -157.49 -167.25 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.044 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 20.0 m -84.46 175.04 9.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 1.1 ptm180 -154.83 155.43 34.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.761 0.315 . . . . 0.0 111.733 -173.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.566 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.2 mt -127.9 123.82 61.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.128 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.9 t -106.53 134.84 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -119.09 125.76 50.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.94 -177.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ILE . . . . . 0.445 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 11.0 tt -112.08 141.39 24.86 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -68.51 146.5 68.18 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 121.886 1.724 . . . . 0.0 111.029 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.54 63.12 1.87 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.712 176.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.0 t -80.92 22.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.813 0.816 . . . . 0.0 110.946 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.742 HG21 ' HG3' ' A' ' 1' ' ' MET . 5.9 t -66.99 -11.25 56.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.385 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.793 HD23 ' H ' ' A' ' 133' ' ' LEU . 1.9 pt? -74.38 -41.35 61.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.333 0.587 . . . . 0.0 109.989 176.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ASN . . . . . 0.415 ' N ' ' HG ' ' A' ' 133' ' ' LEU . 9.8 t30 -87.83 -46.77 9.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.869 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.02 21.0 3.89 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 132' ' ' THR . 0.0 OUTLIER -58.58 -59.32 5.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.738 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 6.5 p30 -71.86 -26.69 62.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.122 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.95 -48.32 76.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -70.99 -25.58 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.146 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -70.32 -39.66 74.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.866 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.6 mm-40 -75.11 -7.37 53.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.366 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.669 177.582 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 78.4 m . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.499 0.19 . . . . 0.0 110.724 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.457 ' O ' ' HD1' ' A' ' 7' ' ' TRP . 59.6 Cg_endo -73.23 128.44 12.94 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.696 2.264 . . . . 0.0 114.752 -172.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mt 65.15 -98.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.735 167.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -114.56 9.79 16.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 111.849 -164.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.564 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.5 m95 -68.29 119.7 13.25 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.508 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 52.7 mmt-85 -72.68 112.11 8.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.689 0.281 . . . . 0.0 110.77 -175.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.83 121.64 24.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 77.9 t80 -139.72 121.69 15.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 60.02 -99.57 0.09 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.398 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 -11.92 9.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.93 0.395 . . . . 0.0 110.492 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -97.46 174.14 6.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.911 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.564 ' HB3' ' HB3' ' A' ' 7' ' ' TRP . 79.5 m -137.79 131.34 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.505 175.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.408 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 46.3 m-85 -120.62 123.86 43.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.872 -174.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 75.5 t80 -118.53 116.95 34.76 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.177 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.5 Cg_endo -84.93 135.33 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.156 2.571 . . . . 0.0 112.358 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.7 mp -122.73 139.35 54.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 p -108.03 22.83 15.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.13 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -87.47 170.32 11.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.123 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -96.04 115.92 28.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.398 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.411 ' HA ' ' OE2' ' A' ' 121' ' ' GLU . 3.5 mmpm? -148.31 146.58 28.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.8 p -73.99 167.44 21.51 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.623 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 57.9 t90 -65.96 -35.14 79.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.54 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.97 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 31.8 mt-10 -76.86 -32.03 57.22 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.533 ' HB2' HD21 ' A' ' 38' ' ' LEU . 7.1 p -68.55 -39.6 81.03 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.576 177.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.9 -33.67 76.37 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.926 173.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.46 ' HB3' ' HA ' ' A' ' 26' ' ' GLU . 8.2 ttt180 -73.03 -42.05 63.57 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.099 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.48 -32.0 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.246 0.546 . . . . 0.0 109.999 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.9 m -84.82 178.15 7.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 170.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 40.2 m 75.86 -44.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.729 0.412 . . . . 0.0 111.061 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.96 -23.9 66.27 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.955 173.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -91.05 7.27 41.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.688 0.28 . . . . 0.0 110.608 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.13 90.7 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.44 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.665 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -101.44 -176.39 3.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.344 -0.428 . . . . 0.0 111.026 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.74 ' CD2' ' HA ' ' A' ' 77' ' ' ASP . 57.9 m-70 -143.76 170.66 15.45 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 174.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 27' ' ' SER . 61.1 mt -68.15 163.12 23.32 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.264 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.958 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.4 tpt -53.85 102.33 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.27 0.557 . . . . 0.0 111.799 -177.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.585 HG22 ' HB3' ' A' ' 75' ' ' TRP . 18.3 p -105.55 104.95 14.77 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.127 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 55.5 mt -74.8 95.32 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.892 -175.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.98 -41.26 36.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.868 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 44.9 p -123.65 161.18 25.58 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.907 0.861 . . . . 0.0 111.675 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.93 -16.47 64.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.876 175.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.862 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -79.67 -38.23 34.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.215 174.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -48.38 -49.37 34.89 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.45 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -66.56 -56.36 11.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.857 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.862 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.7 p30 -65.97 -25.14 66.97 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -170.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -87.26 -35.0 18.74 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.624 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -71.45 -31.72 43.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 120.271 -0.572 . . . . 0.0 111.201 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.4 pt -71.48 -4.67 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.935 0.397 . . . . 0.0 111.111 -179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -86.91 -19.46 28.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.645 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.13 -17.48 17.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.235 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.8 mt -82.83 144.19 30.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.287 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.94 133.34 40.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.982 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -76.43 53.26 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.786 -175.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.625 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -162.47 -31.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.201 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.625 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -87.17 158.97 19.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.22 0.534 . . . . 0.0 111.267 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.8 m -110.51 121.02 44.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.223 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 84.0 m-85 -107.4 123.74 48.81 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.824 ' HA ' HG12 ' A' ' 103' ' ' VAL . 49.2 m-85 -57.89 137.99 56.17 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.753 HD21 ' HG ' ' A' ' 104' ' ' LEU . 85.1 mt -105.14 163.66 12.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.249 173.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.62 14.75 34.31 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.623 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.533 ' HG ' ' CE2' ' A' ' 75' ' ' TRP . 1.1 mt -82.66 116.81 22.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.301 0.55 . . . . 0.0 110.195 178.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.623 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 11.1 ttm180 -113.26 126.26 55.21 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.452 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 12.6 t70 -123.89 145.82 48.85 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 156.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.532 ' HG3' ' HD2' ' A' ' 70' ' ' LYS . 4.8 pt-20 -120.63 6.24 10.54 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -162.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.453 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 179.87 29.92 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.917 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 59.7 38.26 21.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.538 0.685 . . . . 0.0 109.456 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.532 ' HD2' ' HG3' ' A' ' 67' ' ' GLU . 96.8 mttt -81.92 -22.85 36.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.074 -173.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 19.66 56.69 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -175.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -100.39 63.59 1.12 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.198 -0.501 . . . . 0.0 110.253 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.8 m95 -70.06 104.35 2.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.679 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.8 mtm180 -134.11 141.1 47.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.407 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.585 ' HB3' HG22 ' A' ' 40' ' ' THR . 79.9 m95 -88.55 125.27 34.7 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 76' ' ' VAL . 6.2 p -70.63 82.62 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-O 122.141 0.972 . . . . 0.0 110.326 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.74 ' HA ' ' CD2' ' A' ' 37' ' ' HIS . 2.1 t70 -172.88 -59.54 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.591 -174.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 163.34 -31.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.888 1.368 . . . . 0.0 107.615 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.466 ' O ' ' HB2' ' A' ' 75' ' ' TRP . 26.3 m -59.98 120.18 48.14 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.925 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 9.5 Cg_exo -75.49 169.18 22.92 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 123.023 2.482 . . . . 0.0 111.287 173.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 61.3 t80 -64.84 125.38 24.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.707 0.289 . . . . 0.0 110.444 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 4.3 m-80 -80.06 110.49 16.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.4 -31.33 17.88 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.694 2.263 . . . . 0.0 112.307 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.7 -11.91 40.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.524 -178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 76.3 mtt180 -127.91 80.39 1.96 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.994 0.426 . . . . 0.0 111.283 -175.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -121.64 98.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -98.94 69.0 1.75 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -65.8 150.03 49.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.953 0.406 . . . . 0.0 111.007 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.506 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 8.7 t-80 . . . . . 0 C--N 1.326 -0.448 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.452 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 5.1 p30 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 121.587 0.708 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 73.1 m -130.04 127.26 39.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.465 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.585 ' HA ' ' HA ' ' A' ' 115' ' ' ASP . 30.4 m -81.63 145.67 8.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 0.0 111.59 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.824 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -128.2 155.46 39.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.009 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HG ' HD21 ' A' ' 62' ' ' LEU . 25.9 mt -86.43 105.83 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 171.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.99 141.32 35.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 53.7 t80 -93.09 96.62 10.17 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.021 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.477 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 45.5 t-20 -138.83 140.46 38.51 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.38 27.24 16.89 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 5.5 m-20 62.14 17.06 8.84 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.127 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -121.6 133.37 54.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.383 0.611 . . . . 0.0 111.302 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -79.77 124.98 29.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.071 171.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.506 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -163.56 170.12 17.7 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.595 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -73.65 125.81 28.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.242 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.436 HD22 HG13 ' A' ' 116' ' ' VAL . 4.2 t30 -124.59 120.25 31.37 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.585 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 10.5 p-10 -89.79 124.85 35.01 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.465 0.65 . . . . 0.0 110.378 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.436 HG13 HD22 ' A' ' 114' ' ' ASN . 30.1 m -129.38 159.4 69.45 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.965 -178.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -49.57 128.55 21.16 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.52 2.147 . . . . 0.0 110.781 172.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.553 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 10.6 m -74.07 -4.09 33.42 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.901 0.382 . . . . 0.0 111.446 -173.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -90.44 0.5 57.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.552 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -82.99 140.97 32.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.87 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.411 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 8.8 mt-10 -93.05 132.2 37.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.105 0.479 . . . . 0.0 111.153 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -152.9 -171.4 3.92 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.343 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 36.2 m -81.2 170.31 16.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 14.2 ptt180 -149.08 159.85 43.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.201 0.524 . . . . 0.0 112.32 -171.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.958 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 39.9 mt -123.55 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.1 t -112.33 130.4 55.96 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -115.63 123.89 49.55 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.655 -176.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.461 HG22 ' HB2' ' A' ' 14' ' ' CYS . 13.8 tt -114.06 135.83 22.14 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 176.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.72 167.02 22.26 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.413 2.075 . . . . 0.0 111.015 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.9 54.1 2.15 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.058 177.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.7 t -88.06 2.22 52.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.055 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.3 m -61.9 -26.86 68.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.034 0.445 . . . . 0.0 110.487 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.92 -30.07 69.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.301 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -87.5 -14.51 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.203 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.586 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -90.76 22.03 3.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.936 -175.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -64.41 -63.65 1.08 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.166 -0.214 . . . . 0.0 111.426 -176.469 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.55 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 37.7 m-80 -85.18 -23.7 28.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.982 0.42 . . . . 0.0 110.138 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.586 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 2.3 tm? -58.96 -54.88 42.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.928 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.681 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 56.5 t80 -75.58 -20.35 58.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.058 0.456 . . . . 0.0 110.343 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -66.32 -28.33 68.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 0.0 109.851 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -86.95 -31.15 20.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.65 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . 0.681 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 99.0 p . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.462 -171.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.658 ' N ' ' HG1' ' A' ' 132' ' ' THR . 29.6 p . . . . . 0 N--CA 1.451 -0.411 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 12.6 Cg_exo -70.91 170.5 17.81 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.841 2.36 . . . . 0.0 111.401 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.563 ' H ' HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -61.68 -10.34 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.917 0.389 . . . . 0.0 111.193 176.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.37 -35.63 81.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.191 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HD2' ' A' ' 4' ' ' PRO . 16.2 m95 -84.85 142.78 29.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.301 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -85.19 107.34 17.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.801 0.334 . . . . 0.0 110.171 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.39 135.48 39.48 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.86 178.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 78.5 t80 -133.8 110.09 9.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.547 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 67.64 -68.42 0.16 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.041 0.838 . . . . 0.0 110.932 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 p -145.88 -28.24 0.43 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.94 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -86.37 170.95 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.912 0.386 . . . . 0.0 111.15 -174.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.543 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 8.3 m -123.23 132.7 54.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.773 -176.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.472 ' CE1' ' HB2' ' A' ' 127' ' ' LYS . 90.2 m-85 -129.03 129.89 45.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.732 0.301 . . . . 0.0 111.519 -174.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 59.6 t80 -129.5 117.79 18.79 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.891 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -88.58 136.33 3.21 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.293 2.662 . . . . 0.0 112.262 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.58 137.81 52.35 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.8 p -91.05 -4.17 56.58 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.104 0.478 . . . . 0.0 111.061 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.51 ' O ' ' HA ' ' A' ' 123' ' ' SER . 16.3 t70 -77.22 154.01 33.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.935 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.46 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 43.3 m-80 -108.5 140.2 42.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.712 0.291 . . . . 0.0 111.566 -170.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.848 ' HB2' ' HD3' ' A' ' 124' ' ' ARG . 48.8 mmtt -168.22 148.48 4.81 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.231 -177.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.532 HG23 ' OE2' ' A' ' 121' ' ' GLU . 73.2 p -64.47 173.34 2.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.481 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.402 ' HH2' ' HA ' ' A' ' 76' ' ' VAL . 13.2 t90 -60.24 -45.9 91.64 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -61.68 -48.9 78.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.722 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 4.7 mm-40 -60.59 -40.86 93.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.478 179.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.621 ' HA ' ' HD2' ' A' ' 124' ' ' ARG . 70.9 m -56.84 -45.58 82.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.307 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -76.91 -21.43 54.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.989 -176.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 34.7 mtm180 -73.08 -43.32 61.98 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.28 0.562 . . . . 0.0 110.149 173.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.49 -35.6 79.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.809 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' SER . 0.1 OUTLIER -85.56 -179.24 6.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.329 174.139 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 57.8 m 75.25 -43.91 0.52 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.784 0.434 . . . . 0.0 112.06 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.95 -21.06 60.79 Favored Glycine 0 C--O 1.227 -0.3 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.032 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.7 ptp -100.16 8.25 43.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.017 0.437 . . . . 0.0 110.636 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.82 29.97 53.32 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.343 -178.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.86 -178.8 4.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.545 0.212 . . . . 0.0 110.918 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.525 ' HB3' HG11 ' A' ' 76' ' ' VAL . 4.7 m-70 -143.12 168.2 20.31 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -57.42 157.45 6.66 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 111.62 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.633 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.6 tpt -52.92 99.4 0.02 OUTLIER 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.505 -176.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.507 ' H ' ' HG2' ' A' ' 127' ' ' LYS . 7.4 p -97.15 90.44 5.14 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.314 170.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.444 HD11 HD11 ' A' ' 104' ' ' LEU . 42.5 mt -55.65 106.08 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.862 -178.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m -70.78 -51.47 26.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.596 -177.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.6 p -130.12 161.38 31.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.38 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.499 ' CD ' HH21 ' A' ' 84' ' ' ARG . 6.1 pt-20 -66.69 -27.94 68.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.986 0.422 . . . . 0.0 110.293 176.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.02 -36.78 84.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.164 174.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.56 -45.71 91.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.168 176.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 51' ' ' ILE . 55.1 tt0 -56.95 -53.88 52.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.05 175.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -58.87 -24.14 61.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.161 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -81.99 -52.08 7.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -66.92 -30.54 49.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.768 0.318 . . . . 0.0 111.619 -172.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.704 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.3 pt -73.16 -1.41 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.996 0.426 . . . . 0.0 111.746 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -83.58 -26.25 30.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.942 175.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -99.13 -23.78 15.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.484 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 83.6 mt -63.95 135.6 56.64 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.504 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -71.47 124.51 24.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.603 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 81.8 mtt180 -79.05 20.21 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -168.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.873 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.7 ptp180 -116.18 -15.71 11.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.721 0.296 . . . . 0.0 110.356 174.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -97.41 172.64 7.63 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.387 0.613 . . . . 0.0 111.439 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -128.28 117.95 22.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.061 176.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.492 ' HB3' HG13 ' A' ' 125' ' ' ILE . 78.2 m-85 -101.59 127.54 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.315 -171.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.662 ' HA ' HG12 ' A' ' 103' ' ' VAL . 1.7 m-85 -62.04 145.01 54.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.154 0.502 . . . . 0.0 112.232 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.667 ' HB2' HG13 ' A' ' 102' ' ' VAL . 95.9 mt -112.61 168.61 9.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.679 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -74.44 3.8 38.56 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 115.18 0.832 . . . . 0.0 115.18 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.913 ' HB2' HG12 ' A' ' 102' ' ' VAL . 4.0 mm? -73.46 117.34 15.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 118.244 1.022 . . . . 0.0 110.903 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -120.23 122.64 41.36 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.331 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 29.9 t70 -141.78 90.69 2.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.852 0.834 . . . . 0.0 109.911 163.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.679 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -74.45 -71.04 0.36 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.621 -177.767 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -84.67 31.61 0.53 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.459 -170.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 49.73 69.93 0.55 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.219 0.533 . . . . 0.0 111.559 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -95.53 -12.79 25.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.12 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.45 -40.35 2.58 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.014 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -81.16 98.04 7.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.073 0.463 . . . . 0.0 110.751 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.596 ' HB3' HD12 ' A' ' 64' ' ' LEU . 58.6 m95 -59.82 128.04 34.93 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.993 175.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -121.09 129.75 53.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.23 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.756 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 55.6 m95 -81.61 108.14 14.94 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.388 178.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 37' ' ' HIS . 48.0 t 45.77 -80.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.706 1.254 . . . . 0.0 114.117 172.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 75' ' ' TRP . 4.3 t70 -96.33 -82.5 0.39 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.919 -168.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.44 -19.21 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.756 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 70.1 m -62.69 118.71 44.11 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 120.936 0.398 . . . . 0.0 111.928 -170.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.5 Cg_exo -71.09 169.8 19.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.616 2.877 . . . . 0.0 112.555 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.2 151.24 47.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.345 0.593 . . . . 0.0 110.976 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.644 ' ND2' ' HB2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -119.4 127.08 26.65 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.125 -174.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.4 Cg_exo -67.79 -30.3 34.04 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.859 2.373 . . . . 0.0 112.48 175.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.499 HH21 ' CD ' ' A' ' 44' ' ' GLU . 11.2 tpt180 -78.12 -49.81 13.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.564 0.221 . . . . 0.0 111.484 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.644 ' HB2' ' ND2' ' A' ' 82' ' ' ASN . 29.9 mtm180 -80.49 81.25 6.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.069 0.461 . . . . 0.0 110.431 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.501 HG13 ' CD1' ' A' ' 88' ' ' TRP . 95.9 t -138.26 103.75 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.558 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 113' ' ' TRP . 50.7 m-85 -125.93 39.66 3.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.509 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 66.2 m95 -65.77 160.46 22.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.611 0.243 . . . . 0.0 111.461 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 77.3 m-70 . . . . . 0 CA--C 1.517 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.126 -176.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.552 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 6.9 p30 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 121.346 0.593 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 63.9 m -135.93 144.34 45.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.867 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.913 HG12 ' HB2' ' A' ' 64' ' ' LEU . 12.1 p -100.43 146.74 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 120.987 0.422 . . . . 0.0 111.432 -175.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 61' ' ' PHE . 22.6 m -129.85 156.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.763 175.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.8 mt -88.52 113.4 24.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 171.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -125.8 141.33 45.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.397 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 61.3 t80 -79.92 103.84 10.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.151 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 26.1 t-20 -149.19 135.47 19.21 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.451 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 91.4 mt-30 66.38 31.9 7.97 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -172.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.418 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 12.5 m-20 59.53 26.25 15.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.732 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -145.56 153.1 40.72 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.196 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.704 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 88.0 m95 -87.53 107.05 18.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.853 176.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -129.32 167.31 17.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.944 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.531 ' HB3' HG21 ' A' ' 102' ' ' VAL . 25.2 m0 -74.74 129.16 37.21 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.268 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -127.18 139.63 52.81 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -89.19 125.24 34.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.737 0.303 . . . . 0.0 111.178 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -143.41 158.05 58.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.513 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -58.28 138.11 84.12 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.517 2.145 . . . . 0.0 111.771 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.6 m -70.49 -18.76 62.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.714 0.292 . . . . 0.0 111.029 -178.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -86.1 16.07 4.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.294 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -100.07 126.63 46.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.532 ' OE2' HG23 ' A' ' 23' ' ' THR . 3.2 mm-40 -73.49 124.18 25.33 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.404 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -144.16 176.64 9.17 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.475 177.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 35.0 m -67.55 157.62 33.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.894 0.378 . . . . 0.0 110.7 -177.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.848 ' HD3' ' HB2' ' A' ' 22' ' ' LYS . 80.6 mtm-85 -124.18 153.15 41.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.999 0.428 . . . . 0.0 111.984 -169.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 58.9 mt -134.92 120.72 31.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 171.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 12.5 m -103.49 131.75 50.34 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.507 ' HG2' ' H ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -123.33 135.55 54.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.221 0.534 . . . . 0.0 110.006 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.543 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -128.62 140.17 37.68 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.562 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.77 166.88 3.37 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.617 2.212 . . . . 0.0 111.981 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -71.57 59.19 1.24 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.008 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 77.4 p -71.6 -22.44 61.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.069 0.461 . . . . 0.0 110.349 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.658 ' HG1' ' N ' ' A' ' 3' ' ' CYS . 1.8 m -71.93 -14.57 61.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.061 -178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 mp -80.06 -32.35 39.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -31.24 20.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.27 41.6 1.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.52 175.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -44.6 79.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.028 -173.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -72.61 -27.21 62.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.316 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.05 -48.3 74.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -71.53 -23.26 61.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.282 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -67.97 -33.09 73.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 0.0 110.243 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -87.93 -6.47 58.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.435 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.103 -175.829 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.0 m . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -52.82 142.07 52.99 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.063 1.842 . . . . 0.0 111.131 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.3 mt -73.79 80.47 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -173.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 176.68 -51.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.214 -1.357 . . . . 0.0 108.206 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 17.9 m95 -42.23 123.74 2.57 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.295 177.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -71.74 107.21 4.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 128.31 33.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.235 -176.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 83.8 t80 -139.25 102.11 4.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.644 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 60.67 -89.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.139 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 m -120.27 7.56 10.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.682 0.277 . . . . 0.0 111.282 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -130.35 158.51 39.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.856 0.36 . . . . 0.0 110.99 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 128' ' ' ILE . 74.9 m -131.97 127.52 36.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 79.2 m-85 -115.41 129.06 56.45 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -170.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 33.1 t80 -121.34 114.87 31.6 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 174.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 6.5 Cg_endo -88.48 123.36 1.54 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.326 2.684 . . . . 0.0 112.288 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.461 HD22 ' CZ ' ' A' ' 124' ' ' ARG . 4.7 mp -109.82 139.39 44.95 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 p -105.31 14.98 28.07 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.373 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -85.83 162.29 18.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.0 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 20.0 m120 -85.12 118.24 24.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 1.025 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -149.03 141.73 24.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.772 178.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 62.8 p -72.63 174.55 7.39 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 174.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.446 ' CH2' HG23 ' A' ' 76' ' ' VAL . 31.2 t90 -62.42 -39.75 94.29 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.3 68.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.764 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 1.025 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 15.8 mm-40 -61.14 -37.32 82.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.456 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.431 ' HB2' HD21 ' A' ' 38' ' ' LEU . 68.8 m -60.05 -49.29 78.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.715 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.621 ' HG2' HD13 ' A' ' 38' ' ' LEU . 19.6 mm-40 -69.69 -22.02 63.45 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.407 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -67.93 -39.81 83.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.79 0.329 . . . . 0.0 110.918 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.28 -25.98 36.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.333 0.587 . . . . 0.0 109.567 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 88.4 m -85.65 -180.0 6.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.522 172.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 51.7 m 73.34 -44.92 0.6 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.928 0.491 . . . . 0.0 111.66 -178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.63 -22.99 66.59 Favored Glycine 0 C--O 1.227 -0.336 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.758 174.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.5 mtm -96.93 9.53 41.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.33 . . . . 0.0 110.696 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.64 27.75 68.68 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.998 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.85 173.83 10.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.475 0.178 . . . . 0.0 111.028 -175.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -140.2 168.66 19.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.621 HD13 ' HG2' ' A' ' 28' ' ' GLU . 10.8 mp -61.44 149.42 38.63 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.209 0.318 . . . . 0.0 110.37 173.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.4 tpt -50.71 103.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -175.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.515 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 11.8 p -94.45 94.85 8.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.077 172.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.483 HD11 HD11 ' A' ' 104' ' ' LEU . 55.9 mt -66.99 95.8 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.237 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.9 m -92.75 -27.79 17.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.299 0.571 . . . . 0.0 109.811 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 53.0 p -125.2 147.87 48.87 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 122.238 1.018 . . . . 0.0 112.163 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.43 ' OE2' ' HD3' ' A' ' 85' ' ' ARG . 19.9 mt-10 -59.9 -31.45 69.83 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.629 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.446 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.4 -46.04 88.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.582 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.464 ' HB3' ' CE ' ' A' ' 39' ' ' MET . 24.7 mt-10 -49.23 -55.29 13.05 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.583 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.36 -52.69 62.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.001 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -59.25 -34.77 72.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.446 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 59.9 m-85 -88.31 -37.7 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.6 tp -70.21 -30.75 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.283 -174.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.492 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 37.4 pt -71.29 -6.08 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.309 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -87.44 -21.54 25.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.025 176.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -94.81 -23.91 17.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.636 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.6 mt -74.28 139.84 44.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.543 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.421 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -75.36 133.81 41.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 81.5 mtt180 -80.22 16.71 1.19 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -169.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.939 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.9 ptp180 -119.59 -12.31 9.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.719 176.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.939 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -103.11 148.3 25.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.174 0.511 . . . . 0.0 111.607 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 p -100.5 116.91 33.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.541 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB3' HG13 ' A' ' 125' ' ' ILE . 95.4 m-85 -100.77 121.69 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.48 -174.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.838 ' HA ' HG12 ' A' ' 103' ' ' VAL . 14.1 m-85 -58.41 137.42 57.29 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.765 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' A' ' 104' ' ' LEU . 96.4 mt -105.61 157.11 17.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.942 176.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.463 ' O ' ' HE3' ' A' ' 75' ' ' TRP . . . -79.06 61.83 4.07 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.442 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.606 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 21.3 tp -129.64 134.22 47.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -135.33 134.91 40.33 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -170.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -133.61 88.96 2.53 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 164.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -81.84 134.05 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.89 0.376 . . . . 0.0 111.519 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 70.07 18.41 7.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.47 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.23 87.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.314 0.578 . . . . 0.0 111.662 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.467 ' HE3' ' HB2' ' A' ' 70' ' ' LYS . 21.2 mtmt -112.38 -47.72 3.07 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.414 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.8 -19.3 47.59 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -94.9 83.85 4.06 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 121.227 0.537 . . . . 0.0 110.033 176.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.606 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 60.5 m95 -66.23 137.28 56.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.501 -178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.419 ' O ' HD12 ' A' ' 64' ' ' LEU . 63.7 mtt180 -125.65 166.11 17.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.545 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 96.7 m95 -81.56 176.56 9.56 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.719 -0.793 . . . . 0.0 109.307 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.446 HG23 ' CH2' ' A' ' 24' ' ' TRP . 13.7 p -63.07 -34.4 66.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.854 0.359 . . . . 0.0 111.38 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -107.24 -168.78 1.44 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 177.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -77.6 73.72 4.17 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.42 0.629 . . . . 0.0 110.161 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 8.1 m -131.15 129.22 22.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.222 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 19.3 Cg_exo -68.66 144.91 61.83 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.237 2.625 . . . . 0.0 112.271 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 86' ' ' VAL . 68.3 t80 -69.43 143.43 53.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.17 -176.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 25.3 m-80 -77.55 110.39 12.55 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.704 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.94 -50.37 0.84 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.984 2.456 . . . . 0.0 112.776 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -82.71 -0.88 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 111.507 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 29.8 mtm180 -129.55 62.85 1.53 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.408 HG23 ' HZ ' ' A' ' 81' ' ' PHE . 13.0 p -85.31 -32.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.261 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 66.7 -70.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 174.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.419 ' HB3' ' H ' ' A' ' 89' ' ' HIS . 76.8 m95 53.49 -158.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.746 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.565 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 10.4 t-80 . . . . . 0 C--O 1.237 0.404 0 CA-C-O 120.886 0.374 . . . . 0.0 110.952 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 N--CA 1.45 -0.475 0 CA-C-O 121.414 0.626 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 2.2 p -157.66 136.57 11.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.964 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 30.1 m -88.67 147.7 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.408 0.623 . . . . 0.0 112.155 -173.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.838 HG12 ' HA ' ' A' ' 61' ' ' PHE . 25.2 m -124.5 158.62 31.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.14 174.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.7 mt -84.0 115.64 22.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.5 p -125.87 141.49 45.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.688 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 63.4 t80 -91.19 97.5 11.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.4 176.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.413 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 47.7 t-20 -141.38 132.93 26.97 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 66.18 31.85 8.42 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 123.838 0.712 . . . . 0.0 109.32 -171.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 15.2 m-20 60.09 25.06 14.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 114.55 -1.205 . . . . 0.0 112.414 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -132.97 141.58 48.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 0.0 111.018 177.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.492 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 83.2 m95 -88.37 110.77 21.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.762 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.565 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -148.47 170.84 17.14 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.089 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -73.91 134.29 43.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.757 -175.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -134.01 123.93 25.4 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.08 131.68 38.5 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 19.4 m -140.75 158.89 64.46 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.337 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -59.22 128.69 28.45 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.302 2.001 . . . . 0.0 111.138 172.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.556 ' O ' ' HB ' ' A' ' 23' ' ' THR . 83.6 m -65.84 -17.34 64.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -177.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -82.49 -2.29 52.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.771 0.319 . . . . 0.0 111.263 177.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -83.7 115.45 22.19 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 1.4 mt-10 -72.34 110.64 6.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.452 0.644 . . . . 0.0 110.671 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -130.44 -172.05 2.7 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.511 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 33.1 m -78.25 169.57 18.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.461 ' CZ ' HD22 ' A' ' 18' ' ' LEU . 11.9 ptt180 -151.04 150.24 30.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.098 0.475 . . . . 0.0 111.91 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.642 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.1 mt -115.24 121.37 67.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.94 121.46 44.82 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.515 ' HD3' ' H ' ' A' ' 40' ' ' THR . 22.3 ptmt -115.41 127.36 55.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.985 0.422 . . . . 0.0 111.048 -176.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.549 HG22 ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -103.98 134.18 19.85 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.24 167.47 25.79 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.076 1.85 . . . . 0.0 110.938 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -68.26 60.86 0.41 Allowed Glycine 0 CA--C 1.521 0.442 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.131 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -76.63 10.37 2.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.198 0.523 . . . . 0.0 111.304 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.9 m -67.28 -18.58 65.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.583 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.03 -34.48 66.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.182 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -77.42 -38.3 49.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 0.0 109.337 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -85.46 31.22 0.59 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.981 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 12.3 pt-20 -60.12 -35.21 74.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.715 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.411 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 76.8 m-20 -73.31 -28.64 62.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.548 -177.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -68.17 -20.34 64.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.46 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -71.71 -38.58 70.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -73.91 -40.27 63.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.241 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 44.4 m . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.57 -179.269 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.641 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 71.3 m . . . . . 0 C--O 1.234 0.246 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.641 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 95.1 Cg_exo -46.98 147.68 4.74 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 121.818 1.679 . . . . 0.0 111.851 170.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tp -59.38 146.86 8.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.945 -172.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 77.81 -33.79 0.18 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.51 1.124 . . . . 0.0 112.023 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 24.1 m95 -47.73 118.6 2.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.817 0.341 . . . . 0.0 110.124 175.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.3 mmt-85 -71.47 113.45 8.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.481 -172.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.52 124.13 31.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.774 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.457 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 33.0 t80 -121.44 104.33 9.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 58.89 -101.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.435 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 t -96.91 -36.16 10.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.346 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -80.42 169.12 18.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.562 -173.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.96 136.33 26.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.366 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 24.9 m-85 -121.71 131.86 54.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.251 -169.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -111.67 115.26 51.55 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.198 176.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -89.09 124.85 1.5 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 123.107 2.538 . . . . 0.0 111.574 174.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -138.01 143.9 40.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.402 0.62 . . . . 0.0 111.272 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 73.9 p -110.27 18.77 19.56 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.798 -170.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -78.58 130.51 36.02 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.423 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.621 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 4.8 m-20 -63.48 100.52 0.26 Allowed 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.921 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.621 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 14.8 mmmm -133.63 143.75 48.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.626 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.4 p -65.79 163.85 15.9 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 174.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 60.0 t90 -57.76 -39.35 77.2 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.12 -51.67 68.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.892 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HA ' ' HB2' ' A' ' 29' ' ' ARG . 14.5 mm-40 -70.57 -26.92 63.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.239 -177.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 53.1 m -58.0 -50.39 73.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.763 0.316 . . . . 0.0 110.33 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -70.81 -25.89 63.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.658 178.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -71.1 -51.43 25.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.938 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.431 ' HB3' HH12 ' A' ' 124' ' ' ARG . 3.7 t-20 -74.94 -30.67 61.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.1 0.476 . . . . 0.0 110.579 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.5 m -84.51 179.42 7.41 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.2 m 80.04 -45.11 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.532 0.733 . . . . 0.0 109.966 -174.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.67 -25.7 70.53 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.669 171.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.652 ' HG3' ' H ' ' A' ' 36' ' ' ALA . 21.7 ptp -88.7 1.79 54.49 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 110.573 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.44 -13.11 59.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.217 -176.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.652 ' H ' ' HG3' ' A' ' 34' ' ' MET . . . -95.43 141.13 29.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.89 -0.182 . . . . 0.0 110.512 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.543 ' CD2' HG13 ' A' ' 76' ' ' VAL . 13.5 t60 -118.97 158.14 26.34 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.446 ' HB2' HG21 ' A' ' 76' ' ' VAL . 5.9 mp -51.71 139.03 22.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -174.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.655 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.0 tpt -40.02 98.68 0.01 OUTLIER 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.436 -1.256 . . . . 0.0 113.448 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.56 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 6.4 p -94.79 91.84 6.67 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.453 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 59.9 mt -59.4 100.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.279 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -85.64 -34.4 21.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.032 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 35.1 p -130.23 151.61 50.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.379 0.609 . . . . 0.0 111.374 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -65.86 -35.51 80.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.851 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.3 -41.51 98.57 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 120.914 0.387 . . . . 0.0 110.357 175.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.568 ' HB3' ' O ' ' A' ' 43' ' ' THR . 66.4 tt0 -52.34 -51.76 57.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.611 175.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.83 -46.05 90.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.66 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -62.39 -28.36 69.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.116 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.555 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 15.9 m-85 -85.32 -31.87 22.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.8 tp -78.36 -32.69 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.029 -0.668 . . . . 0.0 111.384 -176.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.2 pt -65.28 -20.47 27.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.5 pt20 -87.79 -11.36 48.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.097 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -92.48 -26.34 18.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.049 0.452 . . . . 0.0 110.03 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 68.0 mt -77.05 159.94 29.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.982 -176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.404 ' OD2' HD13 ' A' ' 58' ' ' LEU . 4.2 t70 -70.61 137.75 50.23 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.826 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -90.23 38.82 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.168 0.509 . . . . 0.0 111.698 -171.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -142.15 -46.83 0.35 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.53 172.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.404 HD13 ' OD2' ' A' ' 55' ' ' ASP . 0.2 OUTLIER -61.67 163.49 7.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.797 0.808 . . . . 0.0 112.737 -171.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.875 ' HB3' HG11 ' A' ' 103' ' ' VAL . 1.4 m -108.17 129.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.94 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.516 ' N ' HG22 ' A' ' 103' ' ' VAL . 97.4 m-85 -117.38 120.15 37.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.517 0.198 . . . . 0.0 111.425 -175.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.94 130.15 42.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.084 0.468 . . . . 0.0 111.175 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 104' ' ' LEU . 80.1 mt -111.63 175.93 5.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.337 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.73 39.44 2.71 Favored Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.69 -175.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.717 ' HB2' HG22 ' A' ' 102' ' ' VAL . 3.5 mm? -100.18 114.32 27.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 65' ' ' ARG . 7.9 ttt85 -120.41 114.8 22.35 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -168.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -127.97 105.68 8.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 166.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -46.81 -78.24 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.902 -1.045 . . . . 0.0 113.265 -175.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -127.8 48.06 2.31 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.269 -170.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.35 70.87 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.595 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -87.57 -15.53 37.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.818 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.83 -45.41 3.47 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -175.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.21 92.13 6.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.692 0.758 . . . . 0.0 110.086 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -69.69 160.83 30.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.375 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 16.5 ptt180 -154.1 171.8 18.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.298 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -84.06 -176.18 6.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.976 0.417 . . . . 0.0 110.197 174.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.543 HG13 ' CD2' ' A' ' 37' ' ' HIS . 13.3 p -82.29 1.29 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.215 0.531 . . . . 0.0 111.486 -171.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.506 ' OD2' HG21 ' A' ' 40' ' ' THR . 1.6 p30 -123.89 -104.74 0.36 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.089 176.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -121.16 -23.59 5.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.466 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.1 m -54.46 123.02 41.6 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.634 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 27.3 Cg_exo -65.18 149.06 89.26 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.135 2.556 . . . . 0.0 111.988 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.82 136.92 57.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.838 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -87.81 112.15 47.01 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.88 7.4 4.63 Favored 'Trans proline' 0 CA--C 1.53 0.296 0 C-N-CA 122.646 2.231 . . . . 0.0 113.705 -174.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -119.27 -27.12 5.71 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.418 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -106.83 34.46 3.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.408 ' O ' HG13 ' A' ' 86' ' ' VAL . 6.2 p -80.42 95.76 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.846 0.832 . . . . 0.0 109.811 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -81.71 72.82 8.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.381 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -69.78 152.39 44.66 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.571 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 11.6 t-80 . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.901 -171.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 121.573 0.701 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 67.5 m -117.66 156.27 28.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.831 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.722 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 23.0 m -103.25 155.79 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.255 0.55 . . . . 0.0 110.819 177.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.875 HG11 ' HB3' ' A' ' 59' ' ' SER . 0.4 OUTLIER -123.03 143.98 34.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.533 176.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 62' ' ' LEU . 17.8 tp -85.49 103.54 14.46 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 171.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.482 HG11 ' OD1' ' A' ' 114' ' ' ASN . 10.0 p -128.33 139.2 52.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.176 0.512 . . . . 0.0 111.785 -172.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.569 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 11.6 t80 -88.37 104.49 16.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -146.71 142.02 27.39 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 39.6 mt-30 53.46 65.69 1.45 Allowed 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.638 0.586 . . . . 0.0 110.342 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.1 p30 58.76 4.35 0.38 Allowed 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 173.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' A' ' 108' ' ' GLN . 9.4 pttm -155.56 153.56 30.35 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.569 ' NE1' ' HD2' ' A' ' 106' ' ' TYR . 81.0 m95 -84.07 140.54 31.76 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.019 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.571 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -179.27 -179.4 0.55 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.65 0.594 . . . . 0.0 109.907 173.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.722 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 39.4 m0 -88.48 139.33 30.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.728 0.299 . . . . 0.0 111.03 -177.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.642 HD22 ' C ' ' A' ' 114' ' ' ASN . 0.1 OUTLIER -123.41 162.19 23.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.04 171.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.35 124.69 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.254 0.346 . . . . 0.0 110.928 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -147.77 141.89 16.1 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.204 175.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.0 Cg_endo -55.86 136.02 72.49 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.476 2.117 . . . . 0.0 111.395 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 15.0 m -67.15 -17.43 64.85 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.883 0.373 . . . . 0.0 110.665 -179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.32 7.27 33.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.8 t80 -88.98 143.76 26.63 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.75 135.7 35.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.873 0.368 . . . . 0.0 110.947 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.3 -168.8 1.96 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.543 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.403 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 20.2 m -78.59 169.44 18.24 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.475 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 13.0 ptt180 -147.25 162.91 37.95 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -172.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.655 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 8.3 mm -126.19 123.63 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.249 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 93.0 m -123.21 127.65 48.91 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.996 0.427 . . . . 0.0 110.293 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HD3' ' H ' ' A' ' 40' ' ' THR . 21.6 ptmt -116.29 140.14 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.871 -175.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 16.0 tt -125.96 145.29 51.49 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.211 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.06 167.33 14.43 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.514 2.143 . . . . 0.0 111.444 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.32 74.46 0.54 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.757 175.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 25.8 p -83.19 19.51 1.45 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.506 0.323 . . . . 0.0 111.864 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 14.5 t -60.15 -24.94 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.451 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.6 mt -82.1 -23.83 35.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -89.47 -49.51 6.65 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.341 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.52 33.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.67 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.641 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -59.76 -64.21 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -175.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.641 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 6.2 p30 -84.3 -20.29 32.36 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.66 -45.52 89.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.566 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -72.69 -21.56 61.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.38 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -73.31 -23.42 60.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.357 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 73.5 mt-30 -86.07 -6.8 58.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 177.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.01 -177.206 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.1 m . . . . . 0 C--O 1.233 0.211 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 66.8 Cg_exo -51.9 154.67 9.56 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.567 2.178 . . . . 0.0 112.489 176.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.8 tp -70.2 -14.88 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.817 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.59 -31.74 68.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.987 176.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 24.1 m95 -86.5 160.67 18.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.704 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 48.3 mmt-85 -111.8 122.89 49.02 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.112 177.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.37 124.29 42.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.121 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.468 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 82.9 t80 -121.8 103.27 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.837 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 65.6 -73.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.1 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 m -139.32 5.38 2.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -175.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -123.95 157.88 33.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.788 0.327 . . . . 0.0 111.003 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.8 m -122.87 128.0 49.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.681 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 3.7 m-85 -119.35 138.15 53.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.18 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.425 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 62.1 t80 -139.23 115.68 8.51 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -88.01 138.11 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.839 2.36 . . . . 0.0 112.293 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.8 mp -124.43 139.6 53.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.974 0.416 . . . . 0.0 110.143 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.5 p -110.31 35.19 3.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.871 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.86 -27.23 40.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.3 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.519 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 46.6 m-80 70.08 116.19 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.62 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 13.3 mmmm -159.37 150.44 19.83 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.672 HG23 ' OE2' ' A' ' 121' ' ' GLU . 16.6 p -60.38 166.8 2.83 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 170.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.463 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 63.3 t90 -59.32 -42.26 90.98 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.511 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.41 -51.34 69.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.74 176.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.636 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 32.4 mm-40 -68.14 -31.22 70.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.467 ' HB3' HD21 ' A' ' 38' ' ' LEU . 54.2 m -65.27 -40.74 94.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.822 0.344 . . . . 0.0 110.236 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -71.31 -34.02 70.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.761 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 98.0 mtt180 -69.68 -40.15 76.54 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.845 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -76.16 -25.82 55.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.39 0.614 . . . . 0.0 109.769 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 32' ' ' SER . 67.0 m -85.68 -179.45 6.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 167.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 29.1 m 79.46 -43.68 0.3 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.064 0.546 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.88 -25.18 67.48 Favored Glycine 0 C--O 1.227 -0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.807 173.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 71.5 mtm -94.61 7.1 46.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.871 0.367 . . . . 0.0 110.392 177.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.6 -6.68 64.26 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.152 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.56 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.39 162.83 13.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.522 0.201 . . . . 0.0 110.69 -177.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -133.4 168.57 18.37 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 27' ' ' SER . 76.1 mt -61.39 146.28 48.8 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.931 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.6 tpt -44.88 110.79 0.25 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.161 0.913 . . . . 0.0 113.178 -172.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB3' ' A' ' 75' ' ' TRP . 23.7 p -101.8 105.76 16.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.892 173.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.545 HD11 HD11 ' A' ' 104' ' ' LEU . 45.4 mt -79.2 119.42 28.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.091 0.472 . . . . 0.0 110.538 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.5 p -106.58 -36.62 6.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.261 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 70.5 p -127.71 152.97 47.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 112.032 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.93 -33.05 74.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.53 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -68.29 -44.45 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.622 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -52.54 -48.71 65.94 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.885 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -59.96 -48.94 79.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.978 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -62.19 -23.09 66.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.238 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.429 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 30.5 m-85 -88.33 -39.07 14.64 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 177.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.552 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -71.4 -30.49 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.305 -176.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.1 pt -71.62 -3.96 4.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.85 0.357 . . . . 0.0 111.312 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -87.25 -21.74 25.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.852 175.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 -19.77 18.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.151 178.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 79.1 mt -79.06 134.05 36.77 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.966 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.25 128.29 35.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.964 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.1 mtt180 -72.39 53.78 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -160.33 -29.95 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.317 177.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.702 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -86.9 158.39 19.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.29 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.7 m -109.47 118.89 37.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.527 176.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.754 ' HB3' HG13 ' A' ' 125' ' ' ILE . 91.4 m-85 -105.23 120.91 42.71 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.757 0.281 . . . . 0.0 111.757 -173.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.748 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.8 m-85 -58.6 137.87 57.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.104 0.478 . . . . 0.0 112.048 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.668 HD21 ' HG ' ' A' ' 104' ' ' LEU . 91.1 mt -103.8 166.02 10.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.707 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -87.07 34.74 3.53 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.898 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.6 tp -92.11 114.74 27.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 21.7 ttm-85 -104.19 126.99 51.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -168.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 16.2 t70 -142.24 101.05 3.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.896 168.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.514 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 0.4 OUTLIER -102.18 137.08 40.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.68 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.67 7.17 6.12 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.011 177.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.463 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 69.07 95.94 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.297 0.57 . . . . 0.0 111.448 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.41 ' CB ' ' HG2' ' A' ' 72' ' ' GLN . 92.5 mttt -118.68 -35.73 3.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.78 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.62 -4.28 79.27 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.757 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.41 ' HG2' ' CB ' ' A' ' 70' ' ' LYS . 8.2 pt20 -93.11 100.91 13.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.391 0.615 . . . . 0.0 110.363 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -71.73 112.09 7.54 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.151 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -135.71 141.77 44.95 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 93.9 m95 -78.86 156.92 28.46 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.891 176.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 p -56.9 -45.18 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.36 -174.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -94.03 -158.06 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -81.83 67.8 7.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.187 0.517 . . . . 0.0 110.118 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 13.1 m -130.29 113.05 16.96 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-O 121.305 0.574 . . . . 0.0 110.099 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -69.04 154.43 70.59 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.443 2.762 . . . . 0.0 112.025 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.496 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 85.0 t80 -78.16 133.06 37.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 27.9 m-80 -102.33 104.22 35.94 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.766 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -64.79 -33.62 52.93 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.838 2.359 . . . . 0.0 112.289 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -80.07 -18.31 50.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.057 0.456 . . . . 0.0 110.738 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 82.8 mtt180 -119.28 37.66 4.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.092 0.472 . . . . 0.0 110.995 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.525 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.8 p -93.56 127.93 45.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.432 174.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -110.37 72.14 0.78 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.929 0.395 . . . . 0.0 111.117 -173.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -71.4 174.8 6.07 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.428 0.632 . . . . 0.0 111.423 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.533 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 24.9 m-70 . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 171.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.0 t30 . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.131 0.491 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.2 p -123.24 137.53 54.85 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.968 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.63 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 32.0 m -86.55 148.59 4.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.345 0.593 . . . . 0.0 111.71 -175.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.748 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.4 m -122.06 153.66 26.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.401 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD21 ' A' ' 62' ' ' LEU . 19.1 mt -83.52 106.45 15.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.488 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 7.3 p -125.79 146.2 31.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.442 -177.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.605 ' CE1' ' HA ' ' A' ' 109' ' ' ASP . 86.2 t80 -87.93 109.08 19.53 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.79 -177.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.53 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 19.0 m120 -140.77 127.01 19.71 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 63.21 37.85 10.93 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.42 0.629 . . . . 0.0 109.896 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.605 ' HA ' ' CE1' ' A' ' 106' ' ' TYR . 9.3 t70 73.68 -17.47 0.44 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.117 -1.402 . . . . 0.0 111.959 178.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 112' ' ' ALA . 6.2 pttp -102.22 142.09 34.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.494 0.664 . . . . 0.0 111.029 -175.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -84.35 135.6 34.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.421 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -157.12 165.93 34.65 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.228 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.63 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 20.3 m0 -76.52 123.77 26.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.446 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.488 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 4.6 t30 -111.74 123.62 50.63 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -67.71 123.29 20.09 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.515 0.509 . . . . 0.0 109.871 177.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.474 ' CG2' ' HD2' ' A' ' 117' ' ' PRO . 4.1 p -144.47 146.56 33.13 Favored Pre-proline 0 C--N 1.32 -0.709 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.474 ' HD2' ' CG2' ' A' ' 116' ' ' VAL . 11.6 Cg_endo -57.12 133.29 56.73 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.932 1.754 . . . . 0.0 111.324 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 85.0 m -64.39 -9.36 17.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -96.68 22.64 7.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.03 0.443 . . . . 0.0 110.719 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' THR . 74.1 t80 -99.76 128.04 45.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.698 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.672 ' OE2' HG23 ' A' ' 23' ' ' THR . 45.1 mm-40 -73.67 123.22 23.65 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.519 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -152.05 178.99 8.87 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.1 m -72.96 168.77 18.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -148.19 150.27 33.45 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.998 0.428 . . . . 0.0 112.003 -170.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.754 HG13 ' HB3' ' A' ' 60' ' ' TYR . 54.6 mt -116.91 125.15 73.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.271 173.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.7 t -103.25 126.61 50.5 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -128.9 127.23 41.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.768 -171.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.56 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.8 tt -132.15 141.97 43.34 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.58 157.26 62.6 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 121.942 1.761 . . . . 0.0 110.864 171.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.36 58.03 2.85 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.215 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.3 t -87.03 19.31 3.12 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.125 0.57 . . . . 0.0 110.914 -174.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -28.79 58.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.266 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.5 mt -70.18 -31.7 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.491 . . . . 0.0 110.619 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.01 -39.74 14.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.307 0.575 . . . . 0.0 110.121 177.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.83 38.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.728 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.2 -46.86 79.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.729 0.3 . . . . 0.0 111.576 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.574 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 57.1 t30 -75.22 -30.01 60.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.454 -177.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.546 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 6.9 tt -64.64 -48.19 75.74 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -70.26 -20.66 63.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.274 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -75.2 -32.25 61.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.508 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 78.3 mm-40 -87.39 -6.4 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.93 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.998 -176.434 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' A' ' 7' ' ' TRP . 6.0 p . . . . . 0 N--CA 1.449 -0.482 0 CA-C-O 121.099 0.476 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 3' ' ' CYS . 44.3 Cg_endo -68.4 171.13 13.43 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.135 2.557 . . . . 0.0 111.292 174.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 35.7 mt -70.44 70.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.539 0.685 . . . . 0.0 111.184 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -166.96 -42.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.629 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 37.3 m95 -62.41 119.31 8.86 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 164.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -72.43 109.22 5.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.915 0.388 . . . . 0.0 110.783 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.99 121.48 25.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.251 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.612 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 85.5 t80 -139.15 129.87 26.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.447 ' HG3' ' CD2' ' A' ' 10' ' ' PHE . 52.0 mt-30 66.03 -82.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.697 0.623 . . . . 0.0 110.345 -175.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -152.19 8.64 0.48 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.742 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.439 ' OD1' ' HA ' ' A' ' 129' ' ' PRO . 60.5 m-80 -116.98 166.64 11.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.405 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.745 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 4.1 m -118.03 127.49 53.86 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.612 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 35.7 m-85 -122.52 133.13 54.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.497 0.189 . . . . 0.0 111.034 -174.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 52.5 t80 -140.34 117.35 8.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.857 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.1 Cg_endo -84.22 137.43 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.376 2.717 . . . . 0.0 112.105 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.472 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mp -129.44 140.01 51.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.1 p -101.65 21.94 13.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.947 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.52 149.18 50.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.498 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -83.27 97.67 9.0 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 170.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -143.79 145.91 32.71 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.068 0.461 . . . . 0.0 111.065 -172.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.0 p -80.78 173.78 12.27 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.708 173.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 9.6 t90 -65.25 -35.91 82.48 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -64.0 -48.9 74.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.832 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -62.93 -44.11 96.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.246 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.408 ' HB2' HD11 ' A' ' 38' ' ' LEU . 10.9 p -65.13 -33.1 75.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.647 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' HD21 ' A' ' 38' ' ' LEU . 27.2 tt0 -61.57 -37.82 85.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 174.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 15.6 mmm180 -84.49 -36.81 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.403 -176.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -74.0 -37.92 64.26 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.122 0.487 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.5 m -84.81 177.23 8.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 169.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.744 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 18.8 m 75.77 -48.48 0.6 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.497 0.319 . . . . 0.0 110.594 -175.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.88 -30.68 73.65 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 121.288 -0.482 . . . . 0.0 112.229 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 77.7 mtm -80.32 4.16 18.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.984 0.421 . . . . 0.0 110.788 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.72 51.76 7.76 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.744 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -147.02 -175.49 4.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.086 -0.557 . . . . 0.0 109.91 -173.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -149.29 170.43 18.53 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 175.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 28' ' ' GLU . 4.2 mm? -63.59 157.6 23.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.842 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -61.55 96.41 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.394 0.616 . . . . 0.0 111.586 -177.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.35 98.34 8.72 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.466 176.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.408 HD11 HD11 ' A' ' 104' ' ' LEU . 52.8 mt -64.6 115.51 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.669 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 -28.13 16.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.103 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 25.5 p -141.38 154.91 45.91 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.532 0.682 . . . . 0.0 111.652 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.41 -37.49 83.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.204 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.401 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -59.82 -41.44 91.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.115 0.484 . . . . 0.0 109.999 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' O ' ' A' ' 43' ' ' THR . 70.3 tt0 -51.5 -51.99 50.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.593 174.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HA ' HG22 ' A' ' 50' ' ' ILE . 53.0 tt0 -58.08 -50.4 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.068 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -56.8 -30.85 64.1 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.234 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HA ' HE21 ' A' ' 52' ' ' GLN . 36.6 m-85 -88.53 -39.31 14.25 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.07 -28.56 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.377 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.49 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.9 pt -70.3 -8.8 11.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.963 0.411 . . . . 0.0 111.403 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.466 HE21 ' HA ' ' A' ' 49' ' ' PHE . 50.2 mt-30 -87.68 -18.21 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.308 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -93.03 -20.25 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.068 176.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 82.3 mt -81.84 130.27 35.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.994 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.3 t70 -64.5 136.61 57.23 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 172.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.471 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 84.9 mtt180 -86.99 15.97 5.44 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -169.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.637 ' HG2' HD22 ' A' ' 58' ' ' LEU . 9.8 ptp85 -113.62 -11.99 12.92 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.304 -0.559 . . . . 0.0 111.083 174.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.637 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.3 mm? -99.24 164.56 12.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.284 0.564 . . . . 0.0 111.717 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -120.63 114.4 21.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.254 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 125' ' ' ILE . 47.7 m-85 -102.51 126.62 49.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.587 0.218 . . . . 0.0 111.587 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.785 ' HA ' HG12 ' A' ' 103' ' ' VAL . 33.2 m-85 -62.14 139.87 58.45 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.962 0.41 . . . . 0.0 111.707 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.475 HD21 ' HG ' ' A' ' 104' ' ' LEU . 73.5 mt -105.02 158.56 16.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.145 175.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.4 ' CA ' ' HB3' ' A' ' 38' ' ' LEU . . . -83.2 53.89 4.91 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 114.461 0.544 . . . . 0.0 114.461 -170.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.664 HD21 HG22 ' A' ' 102' ' ' VAL . 2.3 pt? -135.36 150.24 49.89 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -153.35 144.32 22.87 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.433 0.635 . . . . 0.0 111.401 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.825 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 30.7 t70 -107.98 93.57 4.61 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 162.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 3.4 tm-20 -64.97 112.74 3.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.87 -167.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 52.99 34.8 17.77 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.642 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.41 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 66.79 92.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.617 0.723 . . . . 0.0 112.046 175.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 41.3 mttp -126.13 -13.52 6.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 177.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.01 19.73 79.78 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.099 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.79 93.74 4.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.477 0.656 . . . . 0.0 110.706 -178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -71.8 103.24 3.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.541 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -147.92 155.62 41.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.821 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.618 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 80.0 m95 -81.93 168.6 17.73 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 176.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.09 -34.22 67.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -116.09 79.23 1.28 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 70.79 -50.0 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.066 173.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 18.7 m -47.41 124.1 9.07 Favored Pre-proline 0 C--N 1.329 -0.322 0 C-N-CA 123.361 0.665 . . . . 0.0 112.548 -170.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.4 Cg_exo -71.63 153.55 59.8 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 123.168 2.579 . . . . 0.0 111.625 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.51 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 87.4 t80 -61.52 147.06 46.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.366 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.496 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 50.6 m-80 -98.8 100.04 8.9 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.844 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 74.0 Cg_endo -79.65 -24.95 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.355 2.037 . . . . 0.0 112.011 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -91.16 -7.79 50.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.134 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 78.4 mtm180 -134.59 44.97 2.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.12 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 p -95.28 131.55 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.143 0.497 . . . . 0.0 109.839 177.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -115.65 74.5 0.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -175.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -75.12 -179.52 4.42 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 90.9 m-70 . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.405 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.825 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 3.1 t-20 . . . . . 0 N--CA 1.453 -0.291 0 CA-C-O 120.726 0.298 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.7 p -157.0 166.1 34.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.273 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.664 HG22 HD21 ' A' ' 64' ' ' LEU . 1.3 m -115.96 153.86 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.888 -176.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 ' HA ' ' A' ' 61' ' ' PHE . 23.1 m -124.88 153.47 31.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.132 177.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.475 ' HG ' HD21 ' A' ' 62' ' ' LEU . 23.4 mt -84.55 109.67 18.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 171.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.0 143.24 41.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.562 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -84.25 102.42 12.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.446 177.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 19.3 t-20 -147.47 136.73 22.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.668 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.477 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 25.3 mt-30 69.94 31.81 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.994 0.808 . . . . 0.0 109.092 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 t0 63.52 22.11 13.05 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.362 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.61 152.76 40.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.66 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.49 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -77.54 138.4 39.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.547 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -166.99 165.62 15.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.621 0.248 . . . . 0.0 110.95 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -77.74 135.31 38.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.55 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.431 HD22 HG13 ' A' ' 116' ' ' VAL . 6.2 t30 -125.36 135.85 52.85 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -73.31 124.7 26.22 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 123.388 0.43 . . . . 0.0 110.393 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.431 HG13 HD22 ' A' ' 114' ' ' ASN . 17.1 m -143.52 156.42 60.17 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.893 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -67.5 132.18 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.237 1.958 . . . . 0.0 110.907 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 81.9 m -62.37 -21.56 65.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.932 0.396 . . . . 0.0 111.309 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -94.93 64.37 2.83 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.496 0.665 . . . . 0.0 110.099 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -140.65 139.91 34.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.21 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -78.3 110.83 13.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.143 0.497 . . . . 0.0 111.22 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.487 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -147.76 179.09 7.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.457 175.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 p -80.54 174.59 11.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.784 0.326 . . . . 0.0 110.402 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.472 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 19.1 ptt180 -144.96 156.35 43.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.039 0.447 . . . . 0.0 111.564 -171.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.842 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 30.6 mt -122.41 131.62 72.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.04 124.22 48.1 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 19.7 tptm -112.28 111.75 22.85 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.504 -172.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.745 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 38.1 mt -96.85 124.35 50.41 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.553 174.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.439 ' HA ' ' OD1' ' A' ' 13' ' ' ASN . 40.3 Cg_endo -69.07 168.74 19.78 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.673 2.249 . . . . 0.0 111.279 177.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.59 37.69 0.1 OUTLIER Glycine 0 CA--C 1.526 0.754 0 N-CA-C 114.497 0.559 . . . . 0.0 114.497 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 129' ' ' PRO . 7.2 t -77.54 -17.53 57.84 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.0 m -62.93 -30.45 71.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.941 173.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.45 -29.17 61.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.479 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -79.68 -29.2 40.74 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.569 0.699 . . . . 0.0 109.631 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.628 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.96 44.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.338 176.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.67 -55.02 34.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.898 -175.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 7.5 m-80 -71.84 -27.16 62.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.049 0.452 . . . . 0.0 110.221 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.628 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tm? -60.35 -47.52 85.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.535 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -75.39 -28.12 59.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.571 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.471 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 85.2 t80 -63.36 -25.76 68.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.1 mt-30 -79.24 -8.6 59.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.592 178.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.867 -177.567 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 73.6 m . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.569 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 51.4 Cg_exo -53.71 160.88 4.98 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.473 2.115 . . . . 0.0 112.439 176.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.567 ' H ' HD12 ' A' ' 5' ' ' ILE . 3.5 mp -58.92 135.11 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.814 -174.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 81.4 -18.51 0.48 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.375 1.07 . . . . 0.0 112.383 173.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.569 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 28.4 m95 -58.97 121.11 10.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 5.2 mpt_? -72.96 103.28 3.71 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.371 -175.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.14 120.85 21.21 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.443 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -128.24 104.77 7.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 61.44 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.612 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -110.63 -37.27 5.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.562 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -101.89 173.25 6.49 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.745 -170.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.562 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 58.0 m -135.57 131.28 35.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 127' ' ' LYS . 69.6 m-85 -118.25 126.14 51.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.815 0.341 . . . . 0.0 111.809 -172.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.49 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 67.0 t80 -111.99 119.61 43.9 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.946 177.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.3 Cg_endo -85.65 134.23 4.64 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.2 2.6 . . . . 0.0 112.184 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 138.66 54.6 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.85 0.357 . . . . 0.0 110.179 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 p -88.68 -4.76 58.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.261 0.553 . . . . 0.0 109.916 174.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 t70 -56.0 139.06 47.81 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.356 178.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 13.6 m120 -92.82 105.35 17.5 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.609 ' HG3' ' HB2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -139.19 154.08 48.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.775 -178.443 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.5 ' OG1' ' HG2' ' A' ' 26' ' ' GLU . 57.4 p -80.11 168.59 18.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.403 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 23.4 t90 -59.92 -39.83 86.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.041 0.448 . . . . 0.0 110.41 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.12 -48.7 50.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.354 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.609 ' HB2' ' HG3' ' A' ' 22' ' ' LYS . 12.0 mm-40 -69.38 -28.81 66.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.673 0.273 . . . . 0.0 110.821 -177.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.569 ' HB3' HD21 ' A' ' 38' ' ' LEU . 73.2 m -57.94 -45.68 86.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.985 173.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.493 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 6.6 mm-40 -74.78 -18.77 60.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 177.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -73.84 -35.31 64.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.802 0.334 . . . . 0.0 110.923 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.15 -38.91 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.525 0.679 . . . . 0.0 110.022 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.3 m -87.49 179.15 6.61 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.97 174.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.799 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 62.0 m 73.59 -43.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.482 0.313 . . . . 0.0 111.496 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.12 -22.94 65.57 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.907 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mtm -87.51 12.47 12.26 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.162 0.185 . . . . 0.0 110.768 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.457 ' O ' HG13 ' A' ' 128' ' ' ILE . . . 72.61 38.93 57.07 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -172.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.799 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -134.02 -174.27 3.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.949 -0.626 . . . . 0.0 110.512 -171.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.31 168.08 27.29 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 176.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 27' ' ' SER . 41.2 mt -64.79 146.79 54.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.378 0.535 . . . . 0.0 110.799 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.434 ' HG3' ' CE2' ' A' ' 15' ' ' TYR . 23.5 ttt -59.05 126.13 26.43 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 121.451 0.643 . . . . 0.0 111.972 -176.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 33.4 p -118.72 106.96 13.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.717 173.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.6 mt -58.5 104.23 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.733 -176.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.8 m -89.7 -31.36 17.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.789 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 27.3 p -137.42 152.35 49.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.531 0.682 . . . . 0.0 111.604 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.17 -43.41 98.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.688 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.438 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -60.59 -37.15 80.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.497 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' THR . 40.1 tt0 -55.05 -51.39 66.48 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.386 177.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' ILE . 48.1 tt0 -60.03 -47.34 86.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.695 176.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -57.34 -35.26 69.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.889 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.655 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 35.8 m-85 -84.4 -29.2 26.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.4 tp -78.62 -31.1 15.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.047 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.42 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 32.5 pt -72.48 -4.38 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -176.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 2.7 pt20 -87.88 -20.42 26.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 175.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -94.38 -30.14 14.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 81.9 mt -71.09 144.19 50.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.559 -176.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.519 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -76.06 131.85 39.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.381 176.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.562 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 76.7 mtt180 -84.43 27.47 0.7 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -170.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.817 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.0 ptp180 -126.95 -13.78 5.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.699 0.285 . . . . 0.0 110.848 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.817 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -97.66 157.57 15.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.039 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 p -108.96 115.55 30.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.682 174.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB3' HG13 ' A' ' 125' ' ' ILE . 96.2 m-85 -99.55 123.86 44.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -61.39 139.06 58.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.997 0.427 . . . . 0.0 111.824 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.5 mt -114.42 175.49 5.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.145 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.08 -2.37 90.43 Favored Glycine 0 CA--C 1.521 0.468 0 C-N-CA 120.903 -0.665 . . . . 0.0 114.407 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.492 ' HB2' HG22 ' A' ' 102' ' ' VAL . 15.0 mt -79.68 127.48 32.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.809 0.804 . . . . 0.0 110.742 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HG3' ' SG ' ' A' ' 101' ' ' CYS . 35.0 ttt180 -137.63 129.02 28.03 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 19.0 t70 -94.5 147.27 23.43 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 161.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.03 26.77 1.33 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -179.54 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.249 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.59 32.33 21.68 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -167.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 ptpp? -85.26 -19.42 31.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.741 -173.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.32 5.71 59.96 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.397 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -86.58 82.93 7.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 98.7 m95 -69.34 105.88 2.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.362 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -126.43 146.0 50.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.729 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.54 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 76.5 m95 -84.91 139.56 31.76 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.47 -11.8 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.142 0.496 . . . . 0.0 111.689 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.508 ' HB3' HG21 ' A' ' 40' ' ' THR . 32.6 t70 -99.41 29.24 4.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.306 0.574 . . . . 0.0 109.989 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.36 -12.31 0.73 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.33 177.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.3 m -59.38 131.33 87.83 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.113 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.1 Cg_exo -73.97 159.51 44.61 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.889 2.393 . . . . 0.0 112.044 177.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 52.6 t80 -71.29 139.0 49.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.559 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -90.46 114.76 62.27 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.109 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.526 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.8 Cg_exo -74.7 -12.32 22.17 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.115 2.543 . . . . 0.0 112.899 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.526 ' HD2' ' O ' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -123.89 -43.99 2.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.881 0.372 . . . . 0.0 110.764 178.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -84.05 52.22 2.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 109.842 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.5 p -98.21 -33.56 4.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.567 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 68.44 -65.19 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.424 0.689 . . . . 0.0 112.67 172.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 39.7 m95 53.89 -169.06 0.06 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.586 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 1.5 t-80 . . . . . 0 N--CA 1.449 -0.51 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.896 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 47.3 t-20 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.255 0.55 . . . . 0.0 109.917 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' ' HG3' ' A' ' 65' ' ' ARG . 29.8 m -103.5 136.47 43.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.634 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 26.8 m -93.25 138.78 19.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.152 0.501 . . . . 0.0 110.961 -179.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.61 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.5 m -116.26 147.5 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.712 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HG ' ' CE3' ' A' ' 111' ' ' TRP . 22.6 tp -83.18 101.88 11.5 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -124.76 141.23 45.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.063 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.562 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 38.0 t80 -86.34 99.32 11.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.505 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -142.32 136.74 29.99 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 66.22 28.14 10.11 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -171.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.2 t70 72.0 -3.04 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.694 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -113.45 143.31 44.72 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.787 -0.57 . . . . 0.0 110.964 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.43 ' CE3' ' HG ' ' A' ' 104' ' ' LEU . 93.4 m95 -69.28 130.19 41.91 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 169.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.586 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -149.58 166.54 28.95 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.029 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.634 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 42.9 m0 -96.37 119.36 34.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.264 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 1.8 t30 -104.45 146.16 29.25 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.86 136.38 40.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 101' ' ' CYS . 4.5 p -158.67 143.84 11.91 Favored Pre-proline 0 C--N 1.317 -0.806 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.2 129.09 29.74 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.058 1.839 . . . . 0.0 110.609 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.1 m -57.44 -28.21 63.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.219 0.533 . . . . 0.0 110.261 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -90.85 70.66 6.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 170.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.46 ' O ' ' HA ' ' A' ' 23' ' ' THR . 83.9 t80 -138.14 133.69 33.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.528 175.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 28.2 mp0 -74.62 109.72 8.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.052 0.453 . . . . 0.0 110.629 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -142.84 179.62 6.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.027 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 48.9 m -74.35 168.47 19.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -137.06 147.82 46.39 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.695 -167.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.591 HG13 ' HB3' ' A' ' 60' ' ' TYR . 50.3 mt -132.23 122.23 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 168.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . 0.407 ' SG ' HD23 ' A' ' 38' ' ' LEU . 82.4 m -118.09 143.54 46.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.221 0.534 . . . . 0.0 111.279 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.496 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 22.2 ptmt -112.97 143.02 44.98 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.5 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.562 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 10.0 tt -118.57 136.26 24.03 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.41 ' HG2' HG23 ' A' ' 131' ' ' THR . 19.3 Cg_endo -59.91 166.95 7.77 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.472 2.115 . . . . 0.0 111.96 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -44.14 -39.76 5.45 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.552 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.41 HG23 ' HG2' ' A' ' 129' ' ' PRO . 7.7 p 58.98 -12.07 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 173.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 24.2 p -58.91 -51.77 68.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.601 0.239 . . . . 0.0 110.648 177.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.6 mt -54.26 -24.33 18.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.739 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -87.1 -52.17 5.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.231 0.539 . . . . 0.0 110.229 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.01 22.48 3.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.49 -175.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 132' ' ' THR . 60.2 mm-40 -48.83 -66.14 0.45 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.067 0.46 . . . . 0.0 111.685 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.438 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 92.4 m-20 -74.72 -27.51 60.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.0 -46.22 90.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.76 -24.43 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.432 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 86.5 t80 -67.15 -24.91 65.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 23.7 mt-30 -85.24 -5.19 59.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.439 178.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.831 -177.721 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 m . . . . . 0 C--O 1.234 0.259 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.704 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 44.4 Cg_exo -56.66 163.32 7.21 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.221 1.947 . . . . 0.0 112.007 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.4 tp -56.87 122.15 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.3 t70 66.37 6.18 4.16 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.83 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.704 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 14.5 m95 -63.27 122.95 17.43 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 170.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.594 ' HB3' ' HB2' ' A' ' 15' ' ' TYR . 4.8 tpp180 -72.24 97.59 2.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.015 -165.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -76.42 121.78 23.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.051 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.412 ' HB3' ' OD1' ' A' ' 13' ' ' ASN . 85.1 t80 -132.2 102.21 5.69 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.864 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 67.68 -71.59 0.1 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.196 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -145.88 13.53 1.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.754 0.311 . . . . 0.0 111.47 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 26.0 p30 -132.29 169.26 16.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.437 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 92.6 m -139.77 133.87 31.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.965 0.412 . . . . 0.0 110.012 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.815 ' HE2' ' HG2' ' A' ' 39' ' ' MET . 45.4 m-85 -115.03 142.52 46.52 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -170.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -127.72 113.23 20.72 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.003 169.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -89.92 122.95 1.1 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.095 2.53 . . . . 0.0 112.148 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.506 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.6 mp -112.94 138.8 49.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.903 0.382 . . . . 0.0 110.099 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.8 p -105.65 9.5 33.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.497 -176.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -82.38 136.29 35.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.973 0.416 . . . . 0.0 110.015 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.813 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 16.2 m120 -71.49 100.32 2.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.422 -176.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.535 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 21.2 mmmt -127.24 149.66 49.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.386 177.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 61.7 p -75.21 165.58 24.98 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CZ3' ' HD2' ' A' ' 65' ' ' ARG . 68.4 t90 -56.81 -39.04 73.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.114 0.483 . . . . 0.0 110.276 -179.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.648 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -63.66 -50.88 67.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.91 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -64.84 -36.83 85.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.157 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.1 t -51.35 -47.82 62.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.189 174.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -74.82 -21.07 59.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.175 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 34.1 mmt-85 -82.7 -32.66 27.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.703 0.287 . . . . 0.0 111.339 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -83.32 -38.82 21.58 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.107 0.479 . . . . 0.0 109.916 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.577 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 96.8 m -85.68 177.8 7.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.798 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 35.7 m 76.88 -33.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.812 0.845 . . . . 0.0 110.511 -172.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.84 -32.75 84.91 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.394 -0.431 . . . . 0.0 112.471 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 pmm? -95.25 1.63 54.63 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.956 0.378 . . . . 0.0 110.448 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.03 -6.41 66.62 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.791 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.516 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.02 140.16 30.35 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.487 ' HD2' ' OD2' ' A' ' 77' ' ' ASP . 33.0 t60 -118.66 165.51 13.89 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.04 133.96 8.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.988 0.423 . . . . 0.0 111.552 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.815 ' HG2' ' HE2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -58.54 103.73 0.17 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.492 0.663 . . . . 0.0 111.03 178.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.651 ' HA ' ' HZ3' ' A' ' 75' ' ' TRP . 2.0 t -94.3 118.91 32.3 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.412 168.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.712 HD13 ' HE1' ' A' ' 39' ' ' MET . 25.3 mm -61.3 119.95 6.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.4 m -102.75 -45.45 5.0 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.0 p -136.98 163.08 31.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 111.244 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -64.88 -40.56 95.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.052 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.408 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.47 -45.48 90.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.195 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -54.15 -50.45 66.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.726 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -51.7 -50.36 60.65 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.638 176.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -66.26 -41.43 89.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.951 -177.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.408 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 26.1 m-85 -70.19 -41.29 73.89 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.3 tp -69.96 -34.07 58.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.548 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.44 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 33.8 pt -71.91 -3.26 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 120.885 0.374 . . . . 0.0 111.349 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -87.46 -23.96 24.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.416 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 72.9 m-85 -93.14 -21.21 19.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -73.89 142.48 46.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.5 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 15.1 t70 -67.97 119.61 12.9 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.444 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.3 mtt180 -71.33 60.61 0.3 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.449 0.468 . . . . 0.0 111.742 -177.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 1.9 ttp180 -162.54 -29.32 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.293 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -92.35 173.98 7.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.381 0.61 . . . . 0.0 111.948 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.6 p -122.0 129.51 52.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.145 174.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.677 ' HB3' HG13 ' A' ' 125' ' ' ILE . 68.0 m-85 -114.17 126.23 54.83 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 -173.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.643 ' HA ' HG12 ' A' ' 103' ' ' VAL . 38.7 m-85 -61.98 146.94 48.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.1 mt -113.64 176.77 4.89 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.468 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.92 6.18 67.59 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 115.764 1.066 . . . . 0.0 115.764 -169.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 64' ' ' LEU . 1.4 pt? -103.48 138.54 40.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 118.861 1.331 . . . . 0.0 110.894 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.423 ' HD2' ' CZ3' ' A' ' 24' ' ' TRP . 30.3 ttt180 -136.86 137.81 40.09 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.711 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 7.6 t0 -109.82 154.22 23.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 161.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 2.9 pt-20 -145.02 -1.79 0.83 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -167.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -157.32 26.22 0.3 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.96 45.76 20.68 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.52 0.676 . . . . 0.0 109.229 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 66' ' ' ASP . 35.9 mtmt -70.04 -47.29 62.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.104 -173.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.24 -26.76 8.35 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -173.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -89.14 100.06 12.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.092 -0.554 . . . . 0.0 109.615 176.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.537 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 92.1 m95 -70.97 142.83 51.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.579 0.704 . . . . 0.0 112.089 -175.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -140.47 120.12 13.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.699 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HZ3' ' HA ' ' A' ' 40' ' ' THR . 40.7 m95 -79.15 147.21 32.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.912 175.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.2 p -75.01 -13.21 15.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.504 0.669 . . . . 0.0 109.996 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 4.6 m-20 -90.07 18.99 5.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.049 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 47.1 tp60 76.53 -19.72 0.4 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.231 0.612 . . . . 0.0 111.403 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.9 m -55.73 127.42 67.41 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 120.986 0.422 . . . . 0.0 111.556 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -72.55 158.94 50.08 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.532 2.155 . . . . 0.0 110.464 170.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.537 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 64.0 t80 -64.49 117.88 7.97 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.685 -178.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.563 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -90.72 110.79 43.96 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.706 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.99 -20.69 33.44 Favored 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.521 2.147 . . . . 0.0 112.444 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -104.55 2.88 31.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.523 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.563 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 3.6 mmp_? -123.2 22.48 9.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.116 0.484 . . . . 0.0 110.001 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.486 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.6 p -99.52 140.75 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.174 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -124.15 74.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.82 0.343 . . . . 0.0 110.735 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -63.5 156.55 25.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.223 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.602 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 27.1 t-80 . . . . . 0 C--O 1.235 0.324 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.535 -172.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.8 t30 . . . . . 0 N--CA 1.45 -0.463 0 CA-C-O 121.143 0.497 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.507 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.464 ' CG2' HD21 ' A' ' 64' ' ' LEU . 2.1 m -88.74 147.7 5.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.218 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 61' ' ' PHE . 29.0 m -127.43 154.47 37.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.639 176.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.9 mt -82.87 102.96 11.99 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 170.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.33 142.29 22.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.802 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 91.6 t80 -91.33 114.29 26.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.741 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.518 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -151.3 122.55 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.055 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 61.31 47.41 6.95 Favored 'General case' 0 CA--C 1.518 -0.264 0 O-C-N 123.981 0.8 . . . . 0.0 110.017 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 13.6 t70 73.44 -28.3 0.19 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.936 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -97.7 130.31 44.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.78 0.8 . . . . 0.0 112.383 -171.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.444 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 88.1 m95 -79.42 148.81 31.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.462 171.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.602 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -177.09 177.15 1.29 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.394 0.434 . . . . 0.0 111.012 173.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.486 ' CZ3' HG23 ' A' ' 86' ' ' VAL . 8.9 m0 -78.97 134.74 36.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.936 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -136.19 137.65 41.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -79.89 125.04 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.043 0.449 . . . . 0.0 111.343 -177.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.47 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 23.0 m -143.91 160.12 51.0 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.643 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.568 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 15.9 Cg_endo -58.58 140.36 94.45 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.096 1.864 . . . . 0.0 111.365 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.6 m -72.02 -23.71 61.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.808 0.337 . . . . 0.0 110.497 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -94.66 53.21 1.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.53 0.681 . . . . 0.0 110.273 174.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.568 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 66.8 t80 -123.64 125.64 45.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.309 176.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.813 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 1.8 mp0 -68.75 109.3 3.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.974 0.416 . . . . 0.0 110.98 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.465 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -142.52 -177.94 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.877 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 37.9 m -80.53 172.21 14.05 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.789 0.328 . . . . 0.0 110.347 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.506 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 12.3 ptt180 -149.65 148.98 29.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.128 0.49 . . . . 0.0 112.101 -171.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.677 HG13 ' HB3' ' A' ' 60' ' ' TYR . 19.2 mt -119.79 121.55 66.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 173.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 87.5 m -112.62 126.32 55.24 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.265 0.555 . . . . 0.0 110.119 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -112.16 124.93 53.5 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.471 -173.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.516 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 18.4 tt -106.8 144.2 28.59 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.896 -178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HG13 ' A' ' 128' ' ' ILE . 7.9 Cg_endo -54.97 166.03 2.36 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.796 2.331 . . . . 0.0 112.503 172.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -64.53 89.97 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.548 173.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.6 p -61.21 2.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.446 ' H ' ' C ' ' A' ' 130' ' ' GLY . 15.1 t -75.18 -5.1 42.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.618 179.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.4 mp -85.26 -26.31 26.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.701 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -88.91 -50.32 6.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -92.45 35.46 1.02 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.347 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.688 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -72.36 -67.99 0.51 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.443 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.688 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 3.8 p30 -86.81 -22.57 25.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 5.4 tt -55.64 -55.72 28.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -75.0 -19.76 59.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.216 0.531 . . . . 0.0 109.964 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.87 -31.51 70.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.043 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 81.6 mm-40 -86.19 -38.63 17.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.621 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.105 -177.211 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.9 m . . . . . 0 C--O 1.233 0.188 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 42.9 Cg_exo -57.85 152.24 51.43 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.845 1.697 . . . . 0.0 110.979 168.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 15.4 tt -74.61 -18.72 16.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.069 0.461 . . . . 0.0 111.681 -171.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -74.57 -32.19 62.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 34.9 m95 -72.67 128.19 34.82 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 2.0 tpp180 -84.1 121.1 26.97 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.446 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.62 138.76 31.22 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.113 0.482 . . . . 0.0 111.972 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.452 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 84.5 t80 -131.53 102.44 5.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 58.78 -96.51 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.707 -174.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.0 t -105.81 -12.08 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.691 -178.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -93.54 164.49 13.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.697 0.284 . . . . 0.0 111.356 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.9 m -144.12 131.52 20.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.229 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.452 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 2.9 m-85 -123.5 134.77 53.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 -175.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 34.5 t80 -124.62 115.43 26.8 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 174.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -82.57 120.19 3.13 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.13 2.553 . . . . 0.0 112.24 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.653 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -99.29 139.12 35.42 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.995 0.426 . . . . 0.0 110.228 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.0 p -94.43 -3.29 50.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.41 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -65.68 135.68 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.912 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.19 120.75 29.84 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.1 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 43.1 mmtm -144.25 150.97 38.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.363 177.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 119' ' ' ASN . 0.0 OUTLIER -68.96 158.94 33.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 167.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.417 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 82.5 t90 -52.48 -47.26 66.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.705 0.288 . . . . 0.0 111.358 -175.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.14 93.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.274 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.64 -27.13 63.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.955 0.407 . . . . 0.0 110.816 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.8 t -62.52 -43.95 97.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.18 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.562 ' OE2' HG11 ' A' ' 76' ' ' VAL . 8.7 tp10 -79.21 -21.39 46.35 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.311 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.32 -31.13 69.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.987 173.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.414 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.5 t-20 -85.41 -28.26 25.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.432 0.634 . . . . 0.0 109.742 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.459 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 80.9 m -84.61 -179.9 7.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 170.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 72.5 m 73.56 -45.79 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.755 0.422 . . . . 0.0 111.193 -175.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.08 -27.6 70.74 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.66 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 75.3 mtm -92.74 7.37 43.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.806 0.336 . . . . 0.0 110.472 176.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.69 -6.28 70.47 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.367 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.779 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.79 -177.71 3.99 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.538 0.209 . . . . 0.0 111.318 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -148.53 169.76 19.57 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.773 0.429 . . . . 0.0 110.009 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.455 ' HB2' HG21 ' A' ' 76' ' ' VAL . 3.7 mm? -55.0 143.65 25.85 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.068 0.23 . . . . 0.0 110.496 173.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.3 tpt -49.6 109.6 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.654 0.596 . . . . 0.0 111.884 -177.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.65 HG22 ' HB3' ' A' ' 75' ' ' TRP . 27.3 p -107.92 106.76 17.17 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.326 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.9 mt -81.62 116.13 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.932 -176.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.3 p -102.89 -31.56 10.2 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.04 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.6 p -131.16 159.44 37.68 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.522 0.677 . . . . 0.0 111.904 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' HE ' ' A' ' 85' ' ' ARG . 19.8 mt-10 -68.42 -39.41 81.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.711 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.26 -33.52 74.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.597 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -58.84 -50.35 74.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.164 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.43 ' O ' HG23 ' A' ' 51' ' ' ILE . 34.3 tt0 -57.63 -55.44 34.76 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 35.2 m-80 -59.17 -36.96 76.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.069 -175.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -69.49 -47.22 64.57 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 121.278 -0.169 . . . . 0.0 111.106 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.452 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 8.8 tp -70.59 -33.98 55.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.011 0.434 . . . . 0.0 111.58 -174.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.806 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.9 pt -71.06 -11.19 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.946 0.403 . . . . 0.0 110.938 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.9 mt-30 -76.91 -27.55 54.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.634 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.452 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 55.1 m-85 -90.14 -21.77 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.596 -179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.43 150.07 40.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.262 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -67.84 -13.48 62.17 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.701 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 49.5 mtp180 66.84 30.55 7.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.911 0.386 . . . . 0.0 111.099 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.635 ' HB3' HD22 ' A' ' 58' ' ' LEU . 3.7 ttm180 -132.21 -56.36 0.97 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.832 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 57' ' ' ARG . 2.7 mm? -83.27 170.96 14.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.453 -174.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -111.82 125.72 54.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.468 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.594 ' HB3' HG13 ' A' ' 125' ' ' ILE . 21.3 m-85 -108.76 126.52 53.11 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -171.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.44 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.7 m-85 -60.54 149.94 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.758 ' HB2' HG13 ' A' ' 102' ' ' VAL . 90.4 mt -120.91 -178.93 3.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.298 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.538 ' CA ' HG23 ' A' ' 76' ' ' VAL . . . -81.86 -17.94 68.97 Favored Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.749 -0.738 . . . . 0.0 114.193 -176.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.621 ' HB2' ' CG1' ' A' ' 102' ' ' VAL . 83.7 mt -71.78 121.53 19.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 117.666 0.733 . . . . 0.0 110.455 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 ptm85 -129.19 161.76 29.4 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.597 0.713 . . . . 0.0 112.32 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.672 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 1.8 t70 -135.61 151.52 50.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.676 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.986 ' HG2' ' HD2' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -112.07 -33.51 6.23 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -161.42 71.3 0.38 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.251 -172.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.81 36.43 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.041 0.448 . . . . 0.0 111.449 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.986 ' HD2' ' HG2' ' A' ' 67' ' ' GLU . 32.3 mtpt -63.03 127.86 33.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.451 -177.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.65 -14.64 82.21 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.118 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 4.1 pt20 -107.8 113.64 27.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.276 0.56 . . . . 0.0 110.251 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.548 ' HB3' HD22 ' A' ' 64' ' ' LEU . 44.9 m95 -99.33 158.65 15.56 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.779 -178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.509 ' HG2' ' N ' ' A' ' 75' ' ' TRP . 3.6 ttt180 -152.04 149.38 28.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.537 176.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.65 ' HB3' HG22 ' A' ' 40' ' ' THR . 82.4 m95 -82.74 -174.65 5.35 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.568 0.542 . . . . 0.0 109.756 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.562 HG11 ' OE2' ' A' ' 28' ' ' GLU . 35.5 t -81.82 -65.09 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.89 -77.88 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.42 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -153.61 -18.07 0.14 Allowed 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.42 ' H ' ' H ' ' A' ' 78' ' ' GLN . 16.8 m -57.03 118.24 22.76 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.875 -176.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.33 169.71 20.12 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.042 2.495 . . . . 0.0 111.542 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 77.1 t80 -60.49 137.45 58.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 110.001 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -97.24 118.86 64.14 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.784 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.51 -46.61 20.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.327 2.685 . . . . 0.0 113.879 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -85.5 -31.51 22.72 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.589 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -92.08 80.03 5.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 110.133 -176.256 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.0 t -128.61 103.87 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.507 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -127.35 67.51 1.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.338 -173.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.512 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 86.1 m95 -84.93 -166.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.855 0.359 . . . . 0.0 110.595 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.616 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 69.1 m-70 . . . . . 0 CA--C 1.514 -0.404 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 174.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 66' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--O 1.224 -0.243 0 CA-C-O 121.544 0.688 . . . . 0.0 110.717 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.3 m -102.45 139.66 37.77 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.758 HG13 ' HB2' ' A' ' 62' ' ' LEU . 13.8 p -91.53 145.68 7.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -169.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.44 HG12 ' HA ' ' A' ' 61' ' ' PHE . 19.8 m -128.84 155.28 40.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.595 174.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD11 ' A' ' 62' ' ' LEU . 23.1 mt -88.35 118.92 28.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 171.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -130.37 141.62 45.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.42 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -75.64 108.37 8.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.703 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.426 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.9 t-20 -159.08 143.18 15.3 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -177.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 66.73 35.33 5.19 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.314 0.578 . . . . 0.0 109.748 -173.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.69 4.11 4.85 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 114.548 -1.206 . . . . 0.0 112.691 174.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.5 175.44 10.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.882 0.372 . . . . 0.0 110.288 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.806 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 82.2 m95 -85.69 137.64 32.68 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 173.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.616 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -154.93 174.22 15.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.481 176.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.512 ' HB2' ' HA ' ' A' ' 88' ' ' TRP . 51.9 m0 -81.04 136.5 35.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.522 -172.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -129.93 130.07 44.64 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.112 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.82 123.92 27.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.193 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.24 158.63 63.72 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.529 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.43 135.89 67.51 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.332 2.021 . . . . 0.0 111.018 171.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -27.39 66.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.762 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.445 ' HA ' HG22 ' A' ' 23' ' ' THR . 3.8 p30 -86.67 60.34 6.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.824 0.821 . . . . 0.0 110.639 175.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -137.25 116.78 12.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.059 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -63.1 117.98 7.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.071 0.462 . . . . 0.0 111.632 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.412 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -144.39 -176.39 5.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.89 176.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.3 m -78.51 171.82 14.56 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.653 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -152.45 135.66 15.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -167.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.594 HG13 ' HB3' ' A' ' 60' ' ' TYR . 67.6 mt -105.85 127.45 60.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 172.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.74 121.95 45.75 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -112.28 129.2 56.36 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.897 -175.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.779 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.2 tt -129.87 141.13 40.78 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -70.9 166.8 27.84 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.087 1.858 . . . . 0.0 110.57 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.38 57.74 1.57 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.964 176.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -106.07 17.52 23.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.078 0.466 . . . . 0.0 110.98 -173.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 m -61.05 -20.08 62.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.148 0.499 . . . . 0.0 111.228 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.47 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.0 mp -79.84 -26.94 40.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.668 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -88.04 -37.54 16.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.221 0.534 . . . . 0.0 109.91 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.14 40.56 0.99 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.738 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.488 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.58 -57.36 11.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.986 -174.421 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.488 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 9.3 m-80 -74.26 -24.03 59.22 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.75 0.309 . . . . 0.0 110.625 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.97 -51.68 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -70.74 -23.52 62.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.394 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -70.88 -31.72 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.547 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -89.03 -6.37 57.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.456 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.833 -177.314 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB2' HG21 ' A' ' 132' ' ' THR . 72.8 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.981 0.419 . . . . 0.0 112.052 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.88 169.17 19.69 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.829 2.352 . . . . 0.0 110.915 171.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.5 pt -72.27 -18.51 19.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.92 -49.49 70.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.985 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.506 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 25.2 m95 -62.05 139.24 58.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.889 178.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 14.1 mmm180 -84.71 129.51 34.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 111.315 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.37 121.46 42.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.933 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.48 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.4 t80 -121.41 105.16 10.25 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 69.55 -61.98 0.43 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.009 0.818 . . . . 0.0 110.956 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.8 m -152.31 -25.83 0.17 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.795 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -82.9 156.46 23.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -175.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.623 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 23.5 m -120.05 137.71 53.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.134 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.48 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 16.7 m-85 -131.8 135.15 46.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.651 0.262 . . . . 0.0 110.72 -175.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.506 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 41.5 t80 -134.17 117.16 13.5 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.128 175.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -84.65 129.31 4.15 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.727 2.285 . . . . 0.0 112.258 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -104.75 139.35 39.68 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.835 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.5 p -105.53 3.31 29.26 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.214 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -88.08 137.2 32.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.658 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 94.5 m-20 -74.51 122.97 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.279 0.561 . . . . 0.0 111.587 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.596 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 43.7 mmtm -141.19 151.31 43.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.01 175.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 63.5 p -73.07 170.44 14.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 172.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.65 ' HZ3' ' HE ' ' A' ' 65' ' ' ARG . 20.8 t90 -62.6 -35.93 81.11 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.285 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.595 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -62.76 -51.62 66.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.55 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.596 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 11.0 mm-40 -61.53 -34.65 75.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.777 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.575 ' HB3' HD11 ' A' ' 38' ' ' LEU . 56.4 m -64.9 -45.07 87.46 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.367 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 17.2 pt-20 -73.74 -24.92 59.96 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.07 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.5 mtm180 -78.63 -49.67 12.82 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.874 0.369 . . . . 0.0 111.166 177.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.32 -31.53 71.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' SER . 1.3 t -84.52 177.94 7.9 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 172.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 20.6 m 76.88 -46.54 0.51 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 122.506 0.322 . . . . 0.0 110.675 -176.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.63 -33.15 75.95 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 121.221 -0.514 . . . . 0.0 111.937 174.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -79.57 2.07 23.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.849 0.356 . . . . 0.0 110.745 176.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.13 47.85 17.03 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.658 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -148.54 -177.41 5.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -150.64 169.52 21.38 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 173.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.643 ' HB2' HG21 ' A' ' 76' ' ' VAL . 4.1 mm? -57.18 138.8 54.16 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 171.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.411 ' CE ' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -48.88 108.64 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.844 0.715 . . . . 0.0 112.325 -173.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -93.33 88.97 6.18 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.723 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.411 HG12 ' CE ' ' A' ' 39' ' ' MET . 48.2 mt -57.17 111.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.083 -176.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.1 m -93.0 -32.7 14.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.78 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 2.9 t -138.75 153.85 48.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.0 112.128 -177.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' NH1' ' A' ' 85' ' ' ARG . 23.0 mt-10 -61.5 -35.26 77.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.79 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -63.58 -34.94 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.224 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.493 ' HB3' ' O ' ' A' ' 43' ' ' THR . 57.8 tt0 -61.0 -51.41 69.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.316 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' HA ' HG22 ' A' ' 50' ' ' ILE . 50.6 tt0 -62.51 -40.35 96.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.064 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.99 -27.86 69.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 20.8 m-85 -88.3 -34.28 17.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.608 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -69.05 -33.39 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.861 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.5 pt -71.29 -4.45 4.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.86 0.362 . . . . 0.0 111.141 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.93 -27.46 26.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.717 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -89.91 -27.03 20.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.385 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.3 mt -74.89 129.45 37.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.168 -176.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.411 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.8 t70 -57.17 125.85 24.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.753 174.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.428 ' HG2' ' HE1' ' A' ' 111' ' ' TRP . 18.0 mtp180 -75.15 59.23 0.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.578 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.532 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -161.9 -30.93 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.724 177.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.532 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -84.26 172.62 11.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.0 -178.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 m -122.38 122.73 39.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.26 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB3' HG13 ' A' ' 125' ' ' ILE . 70.6 m-85 -110.37 122.04 46.74 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -170.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.583 ' HA ' HG12 ' A' ' 103' ' ' VAL . 39.6 m-85 -60.49 130.54 47.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.964 0.411 . . . . 0.0 111.361 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.516 HD21 ' HB2' ' A' ' 104' ' ' LEU . 95.7 mt -99.95 174.37 6.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.197 178.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.495 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.75 47.95 3.9 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.322 -177.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.32 126.97 49.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.705 0.253 . . . . 0.0 110.359 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.65 ' HE ' ' HZ3' ' A' ' 24' ' ' TRP . 8.1 ttm180 -124.61 124.12 41.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 176.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.476 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 39.1 t0 -116.96 153.72 32.13 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 163.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.677 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 27.9 tt0 -146.87 108.58 4.34 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.278 -168.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.66 HD22 ' HG2' ' A' ' 67' ' ' GLU . 48.8 m-80 68.53 23.83 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.744 0.653 . . . . 0.0 110.674 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.476 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 62.27 84.74 0.13 Allowed 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.985 0.803 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HZ3' ' HB3' ' A' ' 67' ' ' GLU . 64.7 mttp -100.02 157.25 16.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.331 177.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -84.71 -12.34 75.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.094 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -123.8 102.34 7.75 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.338 0.589 . . . . 0.0 110.415 178.241 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 11.7 m0 -78.51 167.91 20.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.272 178.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.612 ' NH2' ' HA ' ' A' ' 78' ' ' GLN . 43.8 ttt-85 -144.11 143.6 31.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.277 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.495 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 67.7 m95 -78.75 167.17 21.59 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 38' ' ' LEU . 69.4 t -60.06 -50.44 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.782 0.325 . . . . 0.0 110.999 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -96.94 77.79 2.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.964 0.411 . . . . 0.0 111.383 -174.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.612 ' HA ' ' NH2' ' A' ' 74' ' ' ARG . 44.5 tp60 69.36 -48.59 0.6 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 169.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 24.1 m -48.69 126.74 13.48 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 122.861 0.464 . . . . 0.0 112.083 -173.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 5.2 Cg_exo -76.6 166.33 27.42 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.979 2.453 . . . . 0.0 111.776 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.563 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 84.1 t80 -53.82 132.79 42.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.14 0.495 . . . . 0.0 110.998 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -112.73 112.78 50.63 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.498 -175.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -67.43 -16.17 47.05 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.181 2.587 . . . . 0.0 112.929 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.411 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.5 tpp180 -100.48 -20.42 15.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.432 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.469 ' NH1' ' HG3' ' A' ' 44' ' ' GLU . 8.6 tpp180 -114.28 70.49 0.73 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.53 0.681 . . . . 0.0 110.11 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.1 p -151.27 142.07 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.754 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -118.3 -37.88 3.27 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.882 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.462 ' O ' ' HB1' ' A' ' 112' ' ' ALA . 99.3 m95 59.11 -165.02 0.2 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.139 -174.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.562 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 12.0 t-80 . . . . . 0 C--O 1.237 0.424 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.031 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 . . . . . 0 N--CA 1.452 -0.346 0 CA-C-O 122.002 0.906 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 97.5 m -110.28 121.99 46.6 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.878 177.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 35.3 m -74.4 136.49 25.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.311 0.577 . . . . 0.0 111.442 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.583 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.8 m -116.89 154.93 18.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.609 176.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.516 ' HB2' HD21 ' A' ' 62' ' ' LEU . 13.8 tp -83.59 100.86 11.08 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -120.18 143.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.433 0.635 . . . . 0.0 111.784 -171.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 56' ' ' ARG . 65.5 t80 -83.61 97.03 8.85 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.76 176.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.522 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -143.83 131.48 21.25 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 85.6 mt-30 66.62 29.34 8.9 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 123.824 0.703 . . . . 0.0 109.302 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 t70 72.82 -14.61 0.57 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.625 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -108.23 138.73 44.02 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.394 0.616 . . . . 0.0 111.245 -176.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.428 ' HE1' ' HG2' ' A' ' 56' ' ' ARG . 92.8 m95 -74.68 131.83 41.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.14 176.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.562 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -160.78 167.36 26.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.765 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 14.7 m0 -80.2 121.46 25.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.785 -177.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -123.83 130.89 53.34 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.531 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.09 125.02 25.77 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.8 m -137.2 159.49 69.51 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.201 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.6 134.99 47.95 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.054 1.836 . . . . 0.0 110.577 172.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 61.0 m -69.17 -35.43 76.29 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.805 0.336 . . . . 0.0 110.364 -175.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.519 ' HA ' ' HB ' ' A' ' 23' ' ' THR . 5.6 t30 -85.49 72.55 10.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.594 0.712 . . . . 0.0 109.412 170.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 23' ' ' THR . 84.9 t80 -137.85 131.59 31.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.95 -1.023 . . . . 0.0 108.798 176.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 26.0 mp0 -75.28 110.15 9.38 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.979 0.419 . . . . 0.0 110.878 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.513 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -146.76 -177.25 5.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.199 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 16.1 m -79.37 173.98 12.03 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.729 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 13.4 ptt180 -154.65 158.84 40.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.818 0.342 . . . . 0.0 111.686 -171.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.598 HG13 ' HB3' ' A' ' 60' ' ' TYR . 49.3 mt -127.17 126.6 68.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.874 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 17.9 m -103.09 131.57 49.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 174.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -119.2 131.31 55.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.032 -176.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.623 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 81.1 mt -107.81 134.23 20.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.126 173.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -67.01 166.33 23.26 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.215 1.943 . . . . 0.0 111.344 177.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.09 54.61 1.44 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.132 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 8.9 t -99.14 -19.06 17.37 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.816 -0.226 . . . . 0.0 110.897 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.456 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 4.4 t -65.93 -37.08 85.12 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 91.0 mt -58.83 -33.61 70.6 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.069 0.461 . . . . 0.0 111.27 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -81.61 -31.25 32.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.306 0.574 . . . . 0.0 109.678 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.51 7.8 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.052 -177.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 133' ' ' LEU . 50.6 mm-40 -62.88 -38.1 89.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 8.7 t30 -69.44 -32.95 72.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.975 176.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.28 -43.84 85.23 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -71.83 -20.75 61.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -68.93 -30.73 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.409 0.623 . . . . 0.0 109.635 173.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 14.3 mt-30 -86.53 -41.26 14.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.985 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.665 -177.88 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 m . . . . . 0 CA--C 1.519 -0.244 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -57.25 146.89 79.79 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.01 1.806 . . . . 0.0 110.994 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.86 -27.8 28.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.195 0.521 . . . . 0.0 110.753 -174.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -71.61 -34.88 70.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.079 176.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -69.88 141.86 53.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.679 ' HD3' ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -91.41 112.16 23.95 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.715 -174.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.79 133.53 35.12 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.022 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 79.1 t80 -138.68 102.57 4.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.977 178.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 63.74 -81.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.966 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.0 m -135.88 12.77 3.39 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.922 0.391 . . . . 0.0 110.986 -176.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -128.02 158.14 38.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.238 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 75.4 m -136.32 127.76 28.52 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 0.0 110.093 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 13.2 m-85 -118.54 138.49 52.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.383 -173.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -118.63 112.81 36.79 Favored Pre-proline 0 C--N 1.318 -0.789 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.884 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -89.8 121.56 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.197 2.598 . . . . 0.0 112.336 178.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.807 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.1 mm? -107.74 138.89 43.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.085 0.469 . . . . 0.0 110.884 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 p -90.87 -5.41 55.58 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.886 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.03 130.35 46.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.201 -1.363 . . . . 0.0 111.201 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -80.49 112.02 17.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.214 -175.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.654 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 39.2 mmtm -143.49 151.15 39.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.866 178.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 43.1 p -74.74 172.21 12.55 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 70.0 t90 -57.04 -41.53 78.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.091 0.472 . . . . 0.0 110.607 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -67.29 -45.19 77.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.397 -178.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 42.8 mt-10 -64.48 -36.63 84.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.46 -177.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -56.69 -44.71 81.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.761 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -79.53 -21.52 45.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.584 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 96.7 mtt180 -69.65 -40.15 76.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.895 0.379 . . . . 0.0 110.766 176.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -78.21 -31.23 49.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.346 0.593 . . . . 0.0 110.151 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 89.0 m -86.89 179.52 6.71 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.324 174.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 70.1 m 74.02 -40.15 0.45 Allowed 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.493 0.717 . . . . 0.0 110.472 -172.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.94 73.6 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 170.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.9 mtm -92.88 7.04 45.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.825 0.345 . . . . 0.0 110.542 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.05 -14.64 48.22 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.664 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' CYS . . . -95.32 141.69 28.6 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.775 -0.25 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.555 ' CD2' HG13 ' A' ' 76' ' ' VAL . 19.9 t60 -118.31 150.52 39.35 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.3 mp -44.77 131.61 6.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.909 0.385 . . . . 0.0 111.929 -175.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.8 ttt -54.0 117.75 3.46 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.736 -169.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.575 HG21 ' OD1' ' A' ' 77' ' ' ASP . 19.2 p -104.79 97.07 7.01 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.22 174.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.09 113.17 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.408 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 m -94.66 -35.43 12.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.659 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 1.8 t -131.31 151.52 51.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.667 0.746 . . . . 0.0 111.887 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -59.83 -35.96 75.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.961 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.462 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.84 -41.06 97.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.997 0.427 . . . . 0.0 110.206 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.4 tt0 -55.02 -50.75 68.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.984 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.45 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.9 tt0 -65.57 -49.24 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 178.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -59.33 -28.07 66.49 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -175.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.462 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 23.8 m-85 -85.97 -42.79 13.71 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.655 178.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.3 tp -68.17 -30.51 48.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.203 -175.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.642 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.0 pt -73.41 -2.64 3.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.479 -177.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -87.62 -23.12 24.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.826 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.679 ' CE1' ' HD3' ' A' ' 8' ' ' ARG . 83.1 m-85 -95.78 -24.95 16.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.602 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -69.51 141.92 53.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.286 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 13.7 t70 -70.03 117.5 11.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.536 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 80.6 mtt180 -76.34 55.79 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.302 0.572 . . . . 0.0 111.405 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 4.2 ttp180 -154.16 -32.68 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.22 152.78 18.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.054 0.454 . . . . 0.0 111.196 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 p -102.0 122.8 44.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.657 173.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.555 ' HB3' HG13 ' A' ' 125' ' ' ILE . 82.7 m-85 -102.25 127.57 49.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.369 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.557 ' HA ' HG12 ' A' ' 103' ' ' VAL . 26.6 m-85 -65.35 139.32 58.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.928 0.394 . . . . 0.0 111.577 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' A' ' 104' ' ' LEU . 86.2 mt -111.69 172.81 6.67 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.324 176.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -77.51 -5.36 85.86 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.535 -177.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.566 HD11 ' HB3' ' A' ' 73' ' ' TRP . 28.6 tp -73.68 115.65 13.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.266 0.533 . . . . 0.0 110.113 -178.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 67' ' ' GLU . 21.4 ttm180 -113.04 144.05 43.26 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.394 -172.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.494 ' N ' ' HG2' ' A' ' 65' ' ' ARG . 11.3 t0 -129.69 127.07 39.76 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 153.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 65' ' ' ARG . 1.0 OUTLIER -105.89 14.38 28.12 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -172.211 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.544 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -163.95 17.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.93 178.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.33 40.13 31.49 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.502 0.668 . . . . 0.0 109.844 -174.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.653 ' HE2' ' HB2' ' A' ' 72' ' ' GLN . 14.2 mtmm -71.53 -24.9 62.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.736 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.26 6.7 70.86 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -174.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.653 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . 74.0 mt-30 -117.66 90.22 3.29 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.473 -178.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.566 ' HB3' HD11 ' A' ' 64' ' ' LEU . 98.6 m95 -72.26 129.92 39.57 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.167 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 62.8 mtm180 -132.48 142.7 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.437 ' CE3' HG22 ' A' ' 40' ' ' THR . 98.2 m95 -74.16 169.91 16.6 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.886 0.374 . . . . 0.0 110.452 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.555 HG13 ' CD2' ' A' ' 37' ' ' HIS . 12.7 p -78.78 -3.4 5.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.175 0.512 . . . . 0.0 111.723 -170.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.575 ' OD1' HG21 ' A' ' 40' ' ' THR . 3.4 p-10 -98.89 -80.79 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 175.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.473 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 0.9 OUTLIER -160.14 -23.77 0.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.006 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.6 m -54.53 130.49 63.17 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.805 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 2.9 Cg_exo -77.15 165.78 27.5 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.903 2.402 . . . . 0.0 111.536 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.582 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 91.4 t80 -58.27 132.33 53.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.003 0.43 . . . . 0.0 110.692 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.547 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 0.8 OUTLIER -85.5 122.85 73.38 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.059 -176.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -60.99 -18.42 57.5 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.853 2.369 . . . . 0.0 113.359 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 84' ' ' ARG . 38.6 mtt180 -113.34 16.96 18.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 111.35 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.547 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 19.8 mmt180 -120.57 80.24 1.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 171.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.5 t -126.81 105.04 13.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.032 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.45 96.14 4.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.875 -177.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -121.21 -173.63 2.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.934 0.397 . . . . 0.0 110.625 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 95.4 m-70 . . . . . 0 C--N 1.325 -0.49 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.9 t30 . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.46 152.98 46.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.236 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.614 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 27.5 m -98.36 140.62 17.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.236 0.541 . . . . 0.0 111.209 179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.557 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.2 m -122.96 153.1 27.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 174.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' A' ' 62' ' ' LEU . 15.0 mt -82.89 110.58 18.01 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 173.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.7 p -123.56 136.98 58.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.683 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 58.0 t80 -82.06 96.15 7.67 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.353 176.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 108' ' ' GLN . 27.0 t-20 -143.89 135.33 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 52.4 mt-30 67.87 27.67 7.24 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -173.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 59.55 17.79 6.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.295 -1.321 . . . . 0.0 112.699 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -130.8 136.23 48.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.004 0.43 . . . . 0.0 110.251 175.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.642 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 80.0 m95 -76.65 104.45 7.16 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.683 175.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -137.83 160.99 37.78 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.215 -178.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.614 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 25.0 m0 -72.91 149.45 43.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -176.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.495 HD22 HG13 ' A' ' 116' ' ' VAL . 4.8 t30 -137.37 131.19 31.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.364 175.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.35 123.74 21.58 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 123.655 0.597 . . . . 0.0 110.547 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.495 HG13 HD22 ' A' ' 114' ' ' ASN . 18.6 m -146.52 151.66 43.77 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.586 177.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.69 135.53 62.45 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.201 1.934 . . . . 0.0 110.683 172.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 46.6 m -67.67 -20.6 65.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.916 0.389 . . . . 0.0 110.579 -176.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.439 ' C ' HD22 ' A' ' 119' ' ' ASN . 0.2 OUTLIER -91.43 66.72 5.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.464 0.65 . . . . 0.0 109.305 173.564 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -137.67 114.4 10.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.824 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.02 109.87 1.62 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.114 0.483 . . . . 0.0 110.826 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.462 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -143.54 -171.19 3.46 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.964 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 57.3 m -82.52 173.06 12.32 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.807 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -150.48 152.94 35.0 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -167.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.555 HG13 ' HB3' ' A' ' 60' ' ' TYR . 55.9 mt -136.97 131.41 46.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.96 177.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 90.2 m -120.24 143.89 48.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.184 0.516 . . . . 0.0 110.688 176.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -120.44 129.79 54.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.294 -0.867 . . . . 0.0 111.043 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.6 tt -124.22 144.89 46.83 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.93 156.49 43.69 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 121.7 1.6 . . . . 0.0 110.48 169.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -62.8 -11.09 35.03 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.003 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 58.5 p 62.96 -14.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.803 1.241 . . . . 0.0 113.501 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.654 ' HB ' ' HG2' ' A' ' 136' ' ' GLU . 23.1 p -79.16 -3.1 43.99 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.908 ' H ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -54.36 -33.64 59.51 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.303 172.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.652 ' H ' HD22 ' A' ' 133' ' ' LEU . 51.4 t-20 -90.89 -44.07 9.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.266 168.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.575 ' HB3' ' HA ' ' A' ' 132' ' ' THR . . . -86.24 0.83 52.86 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -164.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.654 ' HG2' ' HB ' ' A' ' 132' ' ' THR . 5.1 mm-40 -68.71 -44.63 73.49 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.503 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 44.2 t30 -71.48 -34.8 70.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.013 176.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.58 -46.45 89.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -66.01 -31.02 71.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.171 177.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.54 -42.54 67.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.212 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.5 mm-40 -78.05 -14.7 59.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.726 -175.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.346 -178.55 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.638 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.6 m . . . . . 0 C--O 1.234 0.279 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.638 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 81.7 Cg_exo -48.48 150.2 6.03 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 121.828 1.685 . . . . 0.0 111.655 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.07 -17.17 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -169.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -78.75 -33.0 46.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.069 0.461 . . . . 0.0 109.964 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.458 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 76.2 m95 -79.92 115.78 19.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.6 tpt180 -72.81 104.67 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.214 0.53 . . . . 0.0 110.358 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.2 133.27 42.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.198 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -134.73 102.24 5.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.411 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.73 -82.89 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.554 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.6 m -133.49 2.38 3.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.821 0.344 . . . . 0.0 111.389 -177.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -117.79 162.9 17.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.8 m -137.98 133.43 33.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.807 0.337 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -127.12 127.9 45.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.716 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.506 ' CD2' HD22 ' A' ' 18' ' ' LEU . 49.2 t80 -104.11 113.23 65.46 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 8.5 Cg_endo -89.96 119.41 0.81 Allowed 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 123.537 2.824 . . . . 0.0 111.597 174.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.506 HD22 ' CD2' ' A' ' 16' ' ' PHE . 1.1 pt? -135.31 140.57 45.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.448 0.642 . . . . 0.0 110.821 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 34.0 p -101.54 17.71 22.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.92 -172.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -73.23 141.37 47.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 18.5 m120 -67.8 118.7 11.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.571 -178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.89 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 2.3 mmpm? -159.89 146.91 16.38 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.582 0.753 . . . . 0.0 109.519 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.491 HG23 ' OE2' ' A' ' 121' ' ' GLU . 58.1 p -82.32 177.83 8.56 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.218 178.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 84.0 t90 -61.02 -45.68 93.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.91 82.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.595 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.89 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 21.9 mm-40 -63.6 -38.48 91.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.46 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.526 ' OG ' HD13 ' A' ' 38' ' ' LEU . 34.3 t -60.65 -48.66 80.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.803 0.335 . . . . 0.0 110.247 177.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -66.73 -27.02 67.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.67 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -82.83 -46.18 13.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.136 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -69.84 -35.52 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.521 0.677 . . . . 0.0 109.959 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 32' ' ' SER . 69.1 m -87.97 179.5 6.42 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.204 171.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.832 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 63.4 m 78.98 -43.39 0.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 122.905 0.482 . . . . 0.0 110.62 -174.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.82 -14.49 63.13 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.782 172.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.5 mtm -98.61 11.61 37.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.586 0.231 . . . . 0.0 110.9 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.12 -2.24 87.9 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.926 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.832 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -98.38 -173.88 2.68 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.683 0.393 . . . . 0.0 110.208 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CD2' HG13 ' A' ' 76' ' ' VAL . 4.5 t60 -149.19 155.32 40.46 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.526 HD13 ' OG ' ' A' ' 27' ' ' SER . 23.1 tp -56.37 131.51 48.47 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 125' ' ' ILE . 21.4 ttt -50.46 125.78 13.62 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -168.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 16.9 p -118.18 102.67 9.18 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.377 176.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -73.29 112.67 9.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.646 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.9 t -102.91 -29.68 11.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.513 -177.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 71.0 p -123.3 151.39 42.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.555 0.693 . . . . 0.0 112.049 -175.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -63.1 -40.2 96.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.102 179.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.41 -38.58 90.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.589 177.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 43' ' ' THR . 88.7 tt0 -54.85 -50.77 67.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.882 175.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.836 HE22 HD11 ' A' ' 104' ' ' LEU . 20.7 tp60 -59.16 -53.87 53.46 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 177.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.257 -175.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.587 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 47.5 m-85 -88.33 -18.66 27.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -175.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.1 tp -82.49 -31.97 10.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.272 -0.571 . . . . 0.0 111.153 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.435 HG23 HE21 ' A' ' 47' ' ' GLN . 31.1 pt -67.9 -9.39 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 30.2 pt20 -86.44 -21.67 26.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.842 0.353 . . . . 0.0 110.561 177.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -89.72 -30.04 18.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.055 0.455 . . . . 0.0 109.934 178.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 52.6 mt -68.84 147.27 51.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.002 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.466 ' HB3' HD23 ' A' ' 58' ' ' LEU . 14.7 t70 -85.09 131.77 34.41 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.401 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.7 mtt85 -78.03 14.47 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.314 -170.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 ttm-85 -105.86 -26.31 11.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.783 0.325 . . . . 0.0 110.726 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' A' ' 55' ' ' ASP . 3.1 mm? -98.51 175.24 6.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.519 0.676 . . . . 0.0 112.119 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.4 m -128.96 122.97 31.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.105 -0.952 . . . . 0.0 108.828 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -108.21 122.88 47.84 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -172.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.453 ' CD2' ' HB3' ' A' ' 122' ' ' ALA . 6.6 m-85 -67.38 140.49 57.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.81 HD11 ' HG ' ' A' ' 104' ' ' LEU . 93.4 mt -121.75 155.81 34.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.234 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.82 44.68 2.81 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.228 -0.51 . . . . 0.0 114.318 -172.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.495 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.7 tp -100.5 115.84 31.05 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -116.91 119.7 36.18 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -167.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.54 154.67 17.14 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 160.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.677 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.9 tt0 -137.74 86.63 2.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.026 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 71.94 36.3 1.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.319 178.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.34 67.21 0.74 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.672 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 53.0 mttp -94.78 -23.04 17.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.774 178.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.26 -19.93 12.0 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.133 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.448 ' HG2' ' HB3' ' A' ' 70' ' ' LYS . 3.7 pt20 -83.86 92.98 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.319 0.58 . . . . 0.0 110.588 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.626 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 89.9 m95 -65.47 104.99 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.063 177.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -123.18 133.62 54.22 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.529 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 97.0 m95 -73.44 151.47 41.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.401 HG13 ' CD2' ' A' ' 37' ' ' HIS . 9.9 p -70.42 -5.84 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -172.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.3 p-10 -106.81 10.37 30.76 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 122.224 -0.297 . . . . 0.0 110.207 177.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 78' ' ' GLN . 5.2 tt0 81.04 6.36 1.33 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 124.275 0.984 . . . . 0.0 111.436 178.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.529 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 41.3 m -61.46 121.83 66.45 Favored Pre-proline 0 C--O 1.237 0.42 0 CA-C-O 121.008 0.432 . . . . 0.0 110.28 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -63.48 145.4 92.11 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 123.082 2.521 . . . . 0.0 112.544 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.626 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 71.9 t80 -61.52 134.26 56.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.108 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.545 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -95.23 106.71 27.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.275 175.296 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 27.3 Cg_exo -62.96 -24.86 74.04 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.631 2.22 . . . . 0.0 112.486 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -99.21 3.68 46.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.325 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.545 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 76.2 mtt180 -134.82 30.26 3.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.853 0.359 . . . . 0.0 111.32 -177.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.481 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 4.9 p -87.86 98.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.759 0.79 . . . . 0.0 109.552 174.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.38 74.14 10.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.481 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -64.23 156.35 29.04 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 173.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.639 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 24.7 t-80 . . . . . 0 C--N 1.324 -0.524 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.606 -173.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.771 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.4 p-10 . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.79 0.328 . . . . 0.0 110.643 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 81.5 m -142.32 127.74 18.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.752 -173.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.657 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 16.8 m -78.9 146.67 7.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.014 0.435 . . . . 0.0 111.239 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 m -125.51 148.44 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.565 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.836 HD11 HE22 ' A' ' 47' ' ' GLN . 5.9 mt -83.88 106.13 15.32 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.4 p -128.54 139.61 51.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.847 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -83.42 97.35 8.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.771 174.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -137.75 139.46 40.11 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.688 -174.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 58.23 49.84 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.4 p30 53.05 18.91 1.23 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.551 1.14 . . . . 0.0 113.394 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HB3' ' NZ ' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -145.69 144.93 30.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.477 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.401 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.0 m95 -79.22 127.74 32.43 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.74 172.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -167.94 173.86 7.86 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.269 0.356 . . . . 0.0 110.259 174.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.657 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.4 m0 -84.17 119.02 24.52 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.998 0.428 . . . . 0.0 111.135 -176.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -105.76 132.39 51.94 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 166.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.771 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 8.4 t70 -85.99 123.79 31.71 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.746 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 42.1 t -132.31 140.61 38.5 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -43.19 127.91 5.48 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.92 2.413 . . . . 0.0 111.668 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 5.8 m -69.65 -6.94 34.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.529 -172.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -96.61 9.64 40.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.433 ' O ' ' HA ' ' A' ' 23' ' ' THR . 80.9 t80 -86.31 132.21 34.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.038 176.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.491 ' OE2' HG23 ' A' ' 23' ' ' THR . 8.6 mm-40 -80.11 116.6 20.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.284 175.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.453 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -142.79 -168.97 2.9 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.531 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.431 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 27.0 m -82.66 171.43 14.03 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -148.79 161.82 41.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.575 HG21 ' SD ' ' A' ' 39' ' ' MET . 4.4 mm -123.75 133.27 69.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.172 172.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 94.7 m -118.82 134.24 55.29 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.362 0.601 . . . . 0.0 110.328 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -112.18 135.95 52.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 -172.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.5 tt -139.06 142.45 33.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -64.52 166.96 16.09 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.306 2.004 . . . . 0.0 111.605 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.473 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -61.83 89.9 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.52 173.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.1 p -72.18 9.22 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 t -70.46 -15.32 62.8 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.82 -20.04 39.88 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.036 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -88.95 -46.99 8.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.228 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.8 26.11 2.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.886 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.19 -48.93 79.25 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -174.713 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 19.2 t-20 -73.93 -30.28 62.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 0.0 110.397 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.88 -45.11 90.87 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -74.63 -21.54 59.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.734 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -70.85 -34.67 71.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.056 0.455 . . . . 0.0 110.241 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -86.7 -6.25 58.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.747 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.211 -175.842 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 C--O 1.234 0.289 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.456 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 83.3 Cg_exo -48.37 143.98 14.24 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.063 2.509 . . . . 0.0 112.728 -177.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 27.9 pt -71.69 -11.56 15.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.34 -172.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.66 -18.95 39.24 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.598 ' HH2' ' HG3' ' A' ' 34' ' ' MET . 16.2 m0 -66.32 162.81 19.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.526 177.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.7 tpp180 -90.3 110.87 21.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.992 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.717 ' HB1' HD21 ' A' ' 133' ' ' LEU . . . -93.26 121.42 34.61 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.567 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 88.0 t80 -136.45 133.97 37.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.955 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.442 ' HG3' ' CE2' ' A' ' 10' ' ' PHE . 48.1 mt-30 57.48 -94.77 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.688 0.618 . . . . 0.0 110.77 -174.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.0 p -141.03 27.72 1.95 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -131.57 160.41 35.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.715 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.61 ' HB2' HG23 ' A' ' 128' ' ' ILE . 7.8 m -117.59 127.36 53.89 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.567 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 22.4 m-85 -117.3 145.83 43.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.55 -174.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.503 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 5.8 t80 -136.41 115.2 10.68 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.305 176.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 4.8 Cg_endo -88.19 117.39 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.385 2.723 . . . . 0.0 111.828 177.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.589 ' HG ' ' NH2' ' A' ' 124' ' ' ARG . 3.5 mm? -95.23 142.13 28.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.422 -178.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 p -110.58 4.51 20.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -81.67 168.51 18.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.354 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.441 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 3.1 p-10 -104.37 129.54 52.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.751 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.586 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 14.4 mmmm -156.17 141.32 17.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.633 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 34.6 p -57.35 160.98 3.61 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 173.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.537 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 52.9 t90 -56.6 -44.13 80.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -55.23 -47.38 75.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.408 177.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.586 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 38.5 mm-40 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.698 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 124' ' ' ARG . 49.5 m -59.25 -48.0 83.26 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.715 0.293 . . . . 0.0 110.66 173.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 36.0 tt0 -56.83 -44.16 81.79 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.797 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 78.0 mtt180 -75.54 -35.11 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.595 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -72.14 -28.72 63.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.442 -170.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 32' ' ' SER . 18.6 m -97.97 127.03 43.66 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 166.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 58.3 p 166.13 -60.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.303 0.377 . . . . 0.0 110.448 -174.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.08 -25.38 59.69 Favored Glycine 0 C--N 1.331 0.283 0 CA-C-N 115.384 -0.826 . . . . 0.0 113.36 -176.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.598 ' HG3' ' HH2' ' A' ' 7' ' ' TRP . 0.9 OUTLIER -86.56 15.46 5.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.8 0.333 . . . . 0.0 110.591 178.409 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.22 23.3 63.57 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.613 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -124.62 -179.09 4.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.361 0.6 . . . . 0.0 111.822 -172.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -137.16 169.12 18.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.521 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 30.4 tp -60.96 128.38 36.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 168.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.658 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 24.6 ttt -47.35 112.26 0.51 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -167.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 p -93.0 110.54 22.01 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.242 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.564 HD13 ' CE ' ' A' ' 39' ' ' MET . 16.5 mm -55.12 106.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 109.523 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -88.47 -38.37 15.06 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.627 -174.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 16.3 p -137.8 154.68 49.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.061 0.458 . . . . 0.0 110.866 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.93 -32.93 74.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.849 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -74.01 -34.69 64.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.729 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB3' ' O ' ' A' ' 43' ' ' THR . 37.0 tt0 -54.98 -50.16 69.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.109 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.743 HE21 HD21 ' A' ' 104' ' ' LEU . 40.4 tt0 -63.02 -47.32 83.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.736 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.849 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.8 p30 -68.43 -28.13 66.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.772 0.32 . . . . 0.0 111.356 -174.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -88.54 -17.78 29.52 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 47' ' ' GLN . 10.2 tp -87.45 -28.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 118.679 0.672 . . . . 0.0 111.09 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.696 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.7 pt -69.9 -11.16 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -87.29 -18.32 30.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.734 0.302 . . . . 0.0 110.672 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -91.65 -22.09 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 109.658 177.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 90.8 mt -74.91 145.33 42.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.458 178.211 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 12.2 t70 -74.72 117.4 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.499 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 43.2 mtt180 -68.98 57.95 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.471 0.482 . . . . 0.0 111.759 -178.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 2.9 ttp180 -158.2 -33.5 0.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 55' ' ' ASP . 2.9 mm? -92.53 167.64 11.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.386 0.612 . . . . 0.0 111.672 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.791 ' HB3' HG21 ' A' ' 103' ' ' VAL . 1.4 m -112.88 118.87 36.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.847 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.403 ' C ' HG23 ' A' ' 103' ' ' VAL . 92.4 m-85 -107.84 121.03 43.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.235 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.536 ' CE2' ' HB3' ' A' ' 122' ' ' ALA . 26.7 m-85 -71.97 144.96 48.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.693 0.283 . . . . 0.0 111.149 177.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.651 HD13 HD23 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -133.2 176.59 8.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 174.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.509 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -79.74 62.51 4.14 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 115.067 0.787 . . . . 0.0 115.067 -167.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.651 HD23 HD13 ' A' ' 62' ' ' LEU . 3.5 mm? -115.12 104.61 12.03 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 166.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.523 ' HB2' HG12 ' A' ' 76' ' ' VAL . 3.3 ttm-85 -93.82 116.91 29.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.197 0.522 . . . . 0.0 111.925 -169.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.701 ' HB3' ' HB2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -134.13 85.77 2.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.381 175.505 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -87.72 31.28 0.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.978 0.894 . . . . 0.0 108.817 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.47 ' HB3' ' NZ ' ' A' ' 70' ' ' LYS . 3.6 t-20 179.05 137.17 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -168.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.51 87.51 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 120.946 0.403 . . . . 0.0 110.152 170.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.592 ' HB2' ' HG2' ' A' ' 72' ' ' GLN . 2.2 ptpp? -126.33 118.91 26.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.821 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.01 54.03 2.19 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.969 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.592 ' HG2' ' HB2' ' A' ' 70' ' ' LYS . 9.8 pt20 -154.26 44.68 0.55 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.684 ' CH2' ' HB3' ' A' ' 100' ' ' ASN . 77.4 m95 -37.11 117.0 0.49 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.5 1.125 . . . . 0.0 112.449 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -117.39 156.89 27.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.068 0.461 . . . . 0.0 111.097 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.509 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 42.1 m95 -86.84 153.37 21.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.674 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 ' HB2' ' A' ' 65' ' ' ARG . 34.7 m -73.33 -6.94 8.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -173.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -129.54 81.75 2.04 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.369 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.516 HE21 ' N ' ' A' ' 79' ' ' THR . 0.0 OUTLIER 68.29 -56.45 0.5 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.273 1.029 . . . . 0.0 113.117 175.077 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.516 ' N ' HE21 ' A' ' 78' ' ' GLN . 18.2 m -44.23 120.16 3.64 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 79' ' ' THR . 33.1 Cg_endo -66.91 169.64 14.42 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.361 2.708 . . . . 0.0 111.957 170.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -54.25 137.62 40.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.721 -177.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -91.09 108.23 26.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.08 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.84 -24.02 25.21 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 113.071 -176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -95.4 -27.39 15.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.778 0.323 . . . . 0.0 111.361 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -112.4 83.72 1.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.167 0.508 . . . . 0.0 111.487 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 t -124.22 100.92 8.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.14 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -98.28 92.34 5.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.677 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -96.09 173.79 7.24 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.517 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 79.8 m-70 . . . . . 0 C--N 1.327 -0.387 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.081 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.701 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 5.1 m-20 . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.709 ' HB2' ' O ' ' A' ' 116' ' ' VAL . 2.3 m 66.8 116.46 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 O-C-N 124.01 0.819 . . . . 0.0 111.6 168.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.63 HG13 ' CH2' ' A' ' 73' ' ' TRP . 4.7 m -107.16 144.98 15.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.645 0.736 . . . . 0.0 112.694 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.791 HG21 ' HB3' ' A' ' 59' ' ' SER . 2.2 p -111.43 148.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.394 175.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.743 HD21 HE21 ' A' ' 47' ' ' GLN . 12.0 mt -82.29 101.65 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 164.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.21 150.21 25.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 -175.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -81.35 115.16 20.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.061 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 40.2 t30 -162.1 129.85 3.99 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.429 ' C ' ' H ' ' A' ' 110' ' ' LYS . 18.3 mt-30 69.09 35.9 2.61 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -173.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.5 t70 71.31 -25.46 0.17 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.802 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' A' ' 108' ' ' GLN . 21.3 pttm -101.2 146.75 27.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.504 0.669 . . . . 0.0 111.15 -173.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.696 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 69.3 m95 -81.91 130.86 35.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.423 172.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -156.17 167.17 31.26 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.567 ' HA ' ' O ' ' A' ' 103' ' ' VAL . 42.0 m0 -71.74 143.59 49.56 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.667 0.605 . . . . 0.0 110.78 -176.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 3.9 t30 -140.52 147.47 39.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.39 174.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.92 124.64 23.56 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.387 0.429 . . . . 0.0 111.039 178.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.709 ' O ' ' HB2' ' A' ' 101' ' ' CYS . 3.5 m -154.89 116.46 2.42 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.694 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.17 147.59 8.1 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.8 2.333 . . . . 0.0 112.777 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.596 ' O ' ' HB ' ' A' ' 23' ' ' THR . 33.5 m -70.22 -11.52 60.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.65 0.262 . . . . 0.0 111.023 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -89.97 6.61 41.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.633 ' O ' ' HA ' ' A' ' 23' ' ' THR . 79.0 t80 -93.99 133.26 37.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.487 ' OE2' HG23 ' A' ' 23' ' ' THR . 7.8 mm-40 -83.67 134.24 34.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.047 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.536 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -159.47 -170.2 2.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.351 174.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 30.0 m -81.0 164.82 22.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.793 -177.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.589 ' NH2' ' HG ' ' A' ' 18' ' ' LEU . 42.1 mtm105 -127.86 161.72 28.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.137 0.494 . . . . 0.0 111.913 -170.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 19.5 mt -134.3 125.25 47.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 57.7 m -102.66 129.69 49.33 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.658 ' HB3' ' HA ' ' A' ' 39' ' ' MET . 1.1 tppp? -114.85 122.55 46.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.007 0.432 . . . . 0.0 110.838 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 14' ' ' CYS . 8.3 tt -129.34 140.94 40.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.024 174.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.462 ' HD2' HG13 ' A' ' 128' ' ' ILE . 19.7 Cg_endo -59.16 153.26 53.79 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.265 1.976 . . . . 0.0 111.914 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -74.35 57.81 2.41 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.073 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.9 t -60.3 -35.32 75.31 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 122.736 0.415 . . . . 0.0 111.132 -178.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.4 p -94.85 2.16 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.957 0.408 . . . . 0.0 111.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.717 HD21 ' HB1' ' A' ' 9' ' ' ALA . 10.5 mp -90.16 -31.38 17.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -87.29 -55.63 3.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.178 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 139' ' ' TYR . . . -90.14 40.06 0.99 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.436 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -50.2 72.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -175.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -80.1 -31.15 39.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.226 0.536 . . . . 0.0 110.285 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.41 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 2.3 tm? -61.24 -44.41 97.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.281 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 135' ' ' ALA . 0.2 OUTLIER -76.09 -25.09 55.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.989 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -67.47 -31.2 71.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -86.92 -5.43 59.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.123 -177.263 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' SG ' ' HA2' ' A' ' 130' ' ' GLY . 13.3 m . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 121.01 0.433 . . . . 0.0 110.216 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 4.6 Cg_endo -86.51 163.02 9.53 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.554 2.836 . . . . 0.0 113.881 -176.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.1 mt 56.88 -98.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.572 171.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -118.93 15.46 13.38 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.537 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 79.0 m95 -68.63 105.09 2.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 30.3 mmt180 -73.35 114.46 11.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.896 -173.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.76 121.73 28.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.766 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.465 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 87.5 t80 -129.93 102.67 6.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.878 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 66.76 -70.7 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.568 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -142.35 -11.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.119 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -100.33 159.06 15.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.9 0.381 . . . . 0.0 111.487 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 73.4 m -133.69 127.95 33.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.668 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.466 ' OH ' ' HG3' ' A' ' 46' ' ' GLU . 13.2 m-85 -121.37 137.75 54.56 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.738 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 33.4 t80 -124.26 114.93 27.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.711 0.291 . . . . 0.0 110.357 176.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 19.2 Cg_endo -89.53 128.13 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 123.346 2.698 . . . . 0.0 112.429 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.572 HD22 ' NH2' ' A' ' 124' ' ' ARG . 4.1 mp -119.36 139.18 52.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.5 p -107.76 19.97 19.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -93.17 138.31 31.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.92 0.39 . . . . 0.0 110.867 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -56.38 115.56 2.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.719 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.491 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -156.11 141.1 17.27 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.904 0.383 . . . . 0.0 110.896 -174.142 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' HG3' ' A' ' 26' ' ' GLU . 77.7 p -81.65 158.46 24.29 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 54.6 t90 -57.17 -45.05 84.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.917 0.389 . . . . 0.0 110.634 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.17 91.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.177 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.545 ' HG2' ' NH1' ' A' ' 29' ' ' ARG . 47.3 mt-10 -72.46 -35.41 68.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.221 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.591 ' HB3' ' HD3' ' A' ' 124' ' ' ARG . 67.3 m -52.3 -51.28 59.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.03 175.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.428 ' CD ' ' HD1' ' A' ' 37' ' ' HIS . 9.8 tp10 -76.69 -21.08 55.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.605 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.545 ' NH1' ' HG2' ' A' ' 26' ' ' GLU . 53.1 ttp180 -68.4 -37.41 80.33 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.079 0.466 . . . . 0.0 110.762 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -81.15 -37.27 29.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.519 0.676 . . . . 0.0 110.035 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 32' ' ' SER . 86.6 m -85.47 179.91 7.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.631 175.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.688 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 27.6 t 79.62 -43.65 0.29 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 122.715 0.406 . . . . 0.0 110.643 -177.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.94 -20.07 64.11 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.325 175.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.3 mtm -92.15 9.22 34.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 0.0 110.343 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.13 51.03 7.11 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -172.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.688 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -144.56 -178.35 5.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.936 0.398 . . . . 0.0 111.446 -170.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.428 ' HD1' ' CD ' ' A' ' 28' ' ' GLU . 2.9 m-70 -159.46 166.84 30.1 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 169.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.92 158.4 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.589 174.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.408 ' SD ' ' HD1' ' A' ' 15' ' ' TYR . 65.3 mmm -46.51 104.19 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -174.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.474 ' HA ' ' CZ3' ' A' ' 75' ' ' TRP . 18.9 p -98.72 93.28 6.0 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.498 0.665 . . . . 0.0 109.388 169.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.5 mt -76.01 122.47 30.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.158 -173.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.0 m -107.86 -27.29 10.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.874 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.1 p -134.53 155.74 49.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.619 0.723 . . . . 0.0 112.241 -176.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -65.67 -37.96 87.96 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.623 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.702 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -69.33 -37.85 77.91 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.466 ' HG3' ' OH ' ' A' ' 15' ' ' TYR . 67.1 tt0 -53.72 -50.62 65.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.584 0.707 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.457 ' NE2' HD13 ' A' ' 51' ' ' ILE . 1.0 OUTLIER -64.14 -48.67 75.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.008 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.702 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.0 OUTLIER -68.12 -27.27 66.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.025 -175.529 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.611 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 3.2 m-85 -80.6 -32.48 36.41 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 178.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.56 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 8.9 tp -78.51 -30.47 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.527 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 40.9 pt -71.17 -9.69 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 11.1 pt20 -87.48 -13.44 43.14 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.382 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.63 -23.6 17.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.2 0.524 . . . . 0.0 109.639 174.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.9 mt -74.31 150.17 40.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.594 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' A' ' 57' ' ' ARG . 45.1 t0 -80.43 127.43 32.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.641 178.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.582 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 75.1 mtt180 -80.28 30.17 0.28 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -167.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.57 ' HG2' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -139.38 -1.2 1.72 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.779 169.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mp -100.74 157.7 16.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.13 0.49 . . . . 0.0 111.397 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.72 ' HB3' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -109.81 117.3 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.427 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 83.6 m-85 -108.77 121.46 45.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.522 0.201 . . . . 0.0 111.201 -176.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -64.99 141.82 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.186 0.517 . . . . 0.0 112.103 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.648 HD11 ' HG ' ' A' ' 104' ' ' LEU . 65.0 mt -107.06 158.73 16.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.152 175.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.58 49.98 4.15 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.217 -174.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.618 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 40.2 tp -131.59 124.07 29.24 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.8 ptm85 -133.99 154.37 51.16 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.748 0.785 . . . . 0.0 112.493 -174.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -112.17 152.52 28.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.216 -1.356 . . . . 0.0 107.359 166.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.591 ' HB3' ' HD2' ' A' ' 70' ' ' LYS . 4.2 tp10 -109.41 104.56 13.67 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.881 -172.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 11.2 m120 72.26 -66.74 0.29 Allowed 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.745 0.653 . . . . 0.0 110.798 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -179.82 80.26 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 123.75 0.82 . . . . 0.0 108.828 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.612 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 17.1 mtpp -101.51 -61.6 1.36 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.329 -174.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 115.53 -21.84 12.44 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.612 ' OE1' ' HB3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -113.96 107.23 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.687 0.756 . . . . 0.0 110.309 177.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.618 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 25.7 m95 -76.15 150.9 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.951 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 143.52 46.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 176.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.474 ' CZ3' ' HA ' ' A' ' 40' ' ' THR . 98.7 m95 -74.98 161.72 29.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.7 p -75.96 -6.57 8.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.384 0.611 . . . . 0.0 111.396 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 15.4 p30 -109.0 21.24 17.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.284 175.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 57.8 tp60 79.29 -8.18 1.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.146 174.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 36.1 m -58.84 124.34 72.87 Favored Pre-proline 0 C--N 1.323 -0.569 0 O-C-N 122.06 -0.4 . . . . 0.0 110.525 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 32.2 Cg_exo -62.54 149.57 90.58 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.534 2.156 . . . . 0.0 111.763 175.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.447 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 76.2 t80 -59.92 122.63 14.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.0 111.756 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.474 ' ND2' ' HB3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -82.19 106.76 7.0 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.49 174.349 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -63.7 -53.27 1.39 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.085 2.523 . . . . 0.0 112.484 -176.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -89.83 34.41 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.975 0.416 . . . . 0.0 111.305 -177.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 82' ' ' ASN . 12.2 tpt180 -140.43 21.73 2.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.215 0.531 . . . . 0.0 109.623 176.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.537 HG23 ' CE3' ' A' ' 113' ' ' TRP . 11.0 p -107.04 148.8 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.11 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -129.0 74.74 1.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.25 -0.18 . . . . 0.0 110.692 -177.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.69 174.25 5.29 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.023 0.439 . . . . 0.0 111.102 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.643 ' CE1' ' HB2' ' A' ' 107' ' ' ASN . 54.5 m-70 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.688 0.28 . . . . 0.0 110.854 -178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.451 -0.387 0 CA-C-O 120.643 0.259 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 56.2 m -136.15 143.27 44.4 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.941 0.401 . . . . 0.0 109.981 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 62' ' ' LEU . 12.1 p -95.04 145.06 8.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.256 0.55 . . . . 0.0 111.841 -171.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 59' ' ' SER . 1.0 OUTLIER -126.95 142.5 43.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.353 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.648 ' HG ' HD11 ' A' ' 62' ' ' LEU . 11.3 mt -83.64 109.44 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 167.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.43 148.28 31.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.609 -176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.582 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 10.2 t80 -87.75 96.09 10.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.095 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.643 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 14.2 m120 -131.48 144.04 50.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 65.89 24.73 11.23 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.62 0.575 . . . . 0.0 109.634 -176.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.64 22.94 12.73 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.833 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -137.08 148.3 46.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.025 0.44 . . . . 0.0 110.65 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.527 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 81.5 m95 -79.66 124.38 28.5 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.493 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -158.27 167.19 30.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.898 0.38 . . . . 0.0 111.096 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.537 ' CE3' HG23 ' A' ' 86' ' ' VAL . 7.6 m0 -78.55 138.75 38.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.969 -176.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -134.64 144.82 48.08 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -86.27 124.86 33.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.866 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.6 m -141.26 158.78 63.32 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.41 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 14.2 Cg_endo -58.1 133.17 53.72 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.406 2.071 . . . . 0.0 111.011 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 24' ' ' TRP . 3.8 t -72.52 -16.99 61.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.992 0.425 . . . . 0.0 111.245 -173.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -89.95 4.6 49.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.009 0.433 . . . . 0.0 110.185 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.516 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 63.3 t80 -81.2 151.01 28.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -102.93 142.34 34.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.23 0.538 . . . . 0.0 110.995 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.91 -167.62 1.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.26 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 26.4 m -78.91 170.99 15.82 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.141 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.591 ' HD3' ' HB3' ' A' ' 27' ' ' SER . 4.2 ttp180 -144.84 145.57 31.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -168.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.668 HG13 ' HB3' ' A' ' 60' ' ' TYR . 9.6 mt -128.4 125.29 63.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 89.8 m -113.04 146.58 38.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.037 0.446 . . . . 0.0 110.512 177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -121.12 132.92 55.15 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.304 -170.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 36' ' ' ALA . 29.3 mt -128.59 141.06 40.27 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.979 176.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.582 ' HB2' HG23 ' A' ' 131' ' ' THR . 13.4 Cg_exo -65.87 133.59 34.29 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.325 1.35 . . . . 0.0 110.251 169.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.483 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -48.24 -55.93 9.84 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 121.224 -0.512 . . . . 0.0 112.105 -177.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . 0.582 HG23 ' HB2' ' A' ' 129' ' ' PRO . 48.0 p 61.93 -31.76 0.08 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.078 1.351 . . . . 0.0 113.849 176.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 130' ' ' GLY . 10.3 t -63.12 -21.83 66.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.462 0.305 . . . . 0.0 111.045 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 133' ' ' LEU . 2.8 mm? -56.37 -21.23 23.44 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.627 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -87.39 -41.68 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.101 0.477 . . . . 0.0 110.195 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.79 16.95 8.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.271 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -55.49 -52.43 63.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.002 0.429 . . . . 0.0 111.246 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -73.77 -27.66 61.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.476 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -63.2 -47.99 80.22 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.645 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 53.2 t80 -75.12 -24.31 58.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.332 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -65.79 -26.56 67.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.347 0.594 . . . . 0.0 109.979 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -83.71 -32.79 25.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.423 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . 0.645 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 96.7 p . . . . . 0 C--O 1.252 1.23 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.577 -170.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 76.2 m . . . . . 0 N--CA 1.455 -0.219 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.557 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 66.2 Cg_exo -53.07 154.15 14.24 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.356 2.037 . . . . 0.0 112.417 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.6 tp -70.47 -17.39 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.092 -171.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -83.16 -23.85 32.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.863 0.363 . . . . 0.0 110.841 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.557 ' HD1' ' HB2' ' A' ' 4' ' ' PRO . 37.2 m95 -82.1 154.86 25.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.027 0.442 . . . . 0.0 110.258 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 34.9 mmt-85 -108.61 118.13 35.97 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.119 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.46 133.05 35.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.974 -174.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.482 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.1 t80 -129.15 102.24 6.38 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 58.31 -97.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.777 -176.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.9 p -93.63 -38.43 11.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.92 -178.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -82.56 168.45 17.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.537 -172.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 72.0 m -146.71 129.46 16.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.579 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.511 ' CE2' ' HE3' ' A' ' 127' ' ' LYS . 5.0 m-85 -120.93 141.91 50.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.578 0.228 . . . . 0.0 110.994 -173.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.42 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 47.4 t80 -128.69 118.23 19.85 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.018 176.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -84.69 120.16 2.34 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.672 2.248 . . . . 0.0 112.07 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.635 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.1 mp -109.08 139.83 43.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.996 0.427 . . . . 0.0 110.188 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.9 p -106.3 13.37 28.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.479 -177.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 12.4 p-10 -79.35 126.24 30.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.57 ' HB2' ' HB3' ' A' ' 121' ' ' GLU . 5.4 p-10 -70.59 104.45 2.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.73 0.776 . . . . 0.0 110.692 -177.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 22' ' ' LYS . 64.3 mmtt -135.71 156.71 48.4 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.217 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.0 p -77.67 171.55 14.77 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.371 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -60.07 -40.25 88.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.194 0.521 . . . . 0.0 109.996 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.7 -48.77 75.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.244 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.667 ' HG2' HH11 ' A' ' 29' ' ' ARG . 19.7 mt-10 -68.2 -34.97 77.25 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.283 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.443 ' HB3' HD11 ' A' ' 38' ' ' LEU . 67.9 m -53.17 -50.46 64.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.008 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HG2' HD13 ' A' ' 38' ' ' LEU . 9.5 mm-40 -72.1 -22.23 61.38 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.724 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.667 HH11 ' HG2' ' A' ' 26' ' ' GLU . 51.1 mtp180 -69.03 -35.53 76.74 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.767 0.318 . . . . 0.0 111.273 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -80.51 -28.52 37.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.556 0.693 . . . . 0.0 109.747 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 93.4 m -85.42 178.61 7.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.473 173.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 t 74.96 -50.65 0.67 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.819 0.447 . . . . 0.0 110.954 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.15 -25.12 69.37 Favored Glycine 0 C--O 1.227 -0.293 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.151 178.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.3 mtm -91.89 6.08 47.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.579 0.228 . . . . 0.0 110.619 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.33 -1.18 87.98 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.64 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.82 -176.75 3.67 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.708 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.17 163.1 40.01 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 176.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 28' ' ' GLU . 5.2 mp -56.16 144.66 28.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.04 0.448 . . . . 0.0 111.528 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.441 ' HA ' ' HD2' ' A' ' 127' ' ' LYS . 14.2 tpt -53.43 113.37 1.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.656 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.429 ' H ' ' CD ' ' A' ' 127' ' ' LYS . 38.6 p -104.62 135.95 45.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.059 171.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.8 mt -105.61 116.79 50.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.159 0.504 . . . . 0.0 110.716 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -97.63 -40.58 8.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.233 -178.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.6 p -135.02 167.23 21.32 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.2 0.524 . . . . 0.0 111.378 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -70.66 -34.71 72.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.845 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -64.08 -46.62 83.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.384 178.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -54.98 -47.77 74.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.092 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 51' ' ' ILE . 35.0 tt0 -59.79 -56.37 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.044 176.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 12.6 m-80 -53.82 -42.19 68.15 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.197 -176.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.436 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 22.6 m-85 -67.19 -44.9 78.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.2 tp -75.52 -32.14 24.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.828 -174.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.577 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.1 pt -70.45 -7.09 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 110.981 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.1 mt-30 -87.13 -23.13 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.678 174.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -89.28 -21.49 23.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.093 0.473 . . . . 0.0 110.156 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 71.2 mt -78.05 145.03 36.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.126 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.424 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.8 t70 -77.65 127.85 33.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.563 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.1 mtt180 -75.86 24.67 0.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -171.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.811 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.9 ptp180 -124.38 -15.75 6.58 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.075 175.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.811 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.4 mm? -95.7 161.99 13.8 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.278 0.561 . . . . 0.0 111.624 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.5 m -118.29 117.08 28.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.225 175.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.728 ' HB3' HG13 ' A' ' 125' ' ' ILE . 87.0 m-85 -102.09 124.86 48.43 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -169.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.493 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -58.85 135.73 57.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.843 0.354 . . . . 0.0 111.812 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.454 HD11 HD13 ' A' ' 104' ' ' LEU . 68.0 mt -115.85 175.0 5.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.272 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.61 -15.91 80.96 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.918 -0.658 . . . . 0.0 114.176 -174.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.574 HD11 ' HB3' ' A' ' 73' ' ' TRP . 47.6 tp -71.08 120.26 16.4 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.956 0.878 . . . . 0.0 110.88 -172.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -116.79 137.82 51.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.956 -174.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.542 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 6.6 t70 -113.21 139.02 49.13 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 158.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 26.0 tt0 -114.34 92.38 3.94 Favored 'General case' 0 C--N 1.31 -1.118 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.435 -173.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.419 ' C ' HD22 ' A' ' 68' ' ' ASN . 0.2 OUTLIER 76.09 -63.79 0.38 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 124.311 1.007 . . . . 0.0 110.001 -176.145 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 179.3 77.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.424 1.078 . . . . 0.0 108.69 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 51.8 mttp -121.76 125.94 47.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.767 -176.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.54 54.55 3.68 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.301 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -154.4 66.14 0.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.363 0.602 . . . . 0.0 110.182 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.574 ' HB3' HD11 ' A' ' 64' ' ' LEU . 91.1 m95 -57.78 128.77 38.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.707 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.723 ' HD3' ' HA ' ' A' ' 78' ' ' GLN . 13.3 ttm180 -137.93 149.63 46.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.338 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.637 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 95.6 m95 -80.33 109.24 14.62 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 171.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.566 HG13 ' H ' ' A' ' 77' ' ' ASP . 2.8 p 28.25 -72.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 175.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.566 ' H ' HG13 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -78.85 -86.75 0.07 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 0.0 111.56 -173.41 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.723 ' HA ' ' HD3' ' A' ' 74' ' ' ARG . 21.6 tp60 -145.99 -1.72 0.75 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.1 0.476 . . . . 0.0 109.87 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.637 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 71.4 m -60.46 117.48 24.95 Favored Pre-proline 0 N--CA 1.452 -0.367 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.384 178.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 28.5 Cg_exo -63.85 147.11 92.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.177 2.585 . . . . 0.0 112.978 -176.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.39 147.01 52.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.472 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -83.6 124.7 75.07 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.304 -177.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.71 -2.66 12.9 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.651 2.234 . . . . 0.0 113.86 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HA ' ' HE ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -130.39 -34.53 1.6 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.79 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -83.47 82.53 8.25 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.969 0.414 . . . . 0.0 110.016 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.87 111.0 28.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.762 -178.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -121.09 91.88 3.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.022 -175.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -99.68 -178.44 3.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 110.98 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.673 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 72.9 m-70 . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.574 172.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 35.1 t30 . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 121.245 0.545 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 59.2 m -120.85 132.92 55.27 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.594 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 15.5 m -88.8 141.85 13.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.291 0.567 . . . . 0.0 111.035 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 61' ' ' PHE . 27.8 m -115.67 152.65 17.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.82 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.454 HD13 HD11 ' A' ' 62' ' ' LEU . 16.7 tp -83.55 101.85 11.74 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 174.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p -118.68 142.51 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.283 0.563 . . . . 0.0 111.283 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.418 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 88.2 t80 -77.86 117.89 19.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.47 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.673 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 22.7 t-20 -151.48 116.38 5.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.467 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 66.03 46.65 2.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.402 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 74.31 -25.45 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.371 1.044 . . . . 0.0 112.231 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -106.22 146.04 30.8 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.457 0.646 . . . . 0.0 111.45 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.577 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 61.5 m95 -91.73 136.36 33.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.193 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -156.04 171.33 20.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.594 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 6.9 m0 -77.84 138.7 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.302 0.377 . . . . 0.0 110.451 -175.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -130.37 129.88 43.67 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.47 124.4 23.47 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.572 0.545 . . . . 0.0 111.417 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.4 m -146.41 157.72 48.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.86 138.46 85.85 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.026 1.817 . . . . 0.0 111.467 174.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.5 m -62.76 -20.1 64.63 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.14 0.495 . . . . 0.0 110.356 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -98.12 80.65 2.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.729 0.776 . . . . 0.0 109.11 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -155.26 110.09 2.98 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.434 -1.257 . . . . 0.0 108.232 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 21' ' ' ASN . 5.6 mp0 -63.28 110.27 1.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.102 0.477 . . . . 0.0 111.224 -175.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -140.35 -174.03 3.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.553 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.6 p -83.15 171.61 13.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.635 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -147.92 147.98 30.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.909 0.385 . . . . 0.0 111.906 -170.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.728 HG13 ' HB3' ' A' ' 60' ' ' TYR . 43.7 mt -117.43 131.76 69.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.3 t -117.54 133.8 55.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' A' ' 15' ' ' TYR . 21.3 ptmt -123.2 139.91 53.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.973 0.416 . . . . 0.0 110.39 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.614 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.9 tt -131.42 140.44 38.45 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 163.76 36.81 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.668 1.578 . . . . 0.0 110.749 170.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.04 59.66 1.41 Allowed Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.967 176.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.2 t -96.52 14.76 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 23.3 m -57.7 -32.4 67.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.728 ' H ' HD12 ' A' ' 133' ' ' LEU . 2.9 mp -71.18 -43.36 67.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.162 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -67.2 -26.31 66.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.468 0.652 . . . . 0.0 110.244 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.28 25.22 1.96 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.317 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 9.2 pt-20 -54.5 -51.43 65.12 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.712 0.291 . . . . 0.0 111.401 -178.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 0.2 OUTLIER -74.13 -32.25 63.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -178.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.37 -46.77 88.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -69.42 -29.31 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.509 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -67.46 -23.8 65.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.706 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 27.7 mt-30 -86.72 -5.57 59.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.642 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.909 -177.566 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.555 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 13.8 p . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.555 ' HD2' ' HB2' ' A' ' 3' ' ' CYS . 79.4 Cg_exo -48.89 139.88 24.5 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.542 2.161 . . . . 0.0 112.313 176.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tt -72.37 89.19 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 121.946 0.879 . . . . 0.0 110.741 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -172.81 -52.48 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.283 -1.326 . . . . 0.0 108.101 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -75.19 128.42 35.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.098 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -74.33 104.22 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.15 0.5 . . . . 0.0 110.686 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . . . -70.55 134.44 47.67 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.959 177.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 74.9 t80 -144.49 124.7 13.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.573 178.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 64.0 -82.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.353 0.661 . . . . 0.0 111.392 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.0 m -146.19 6.99 1.02 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -120.77 166.67 13.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 69.9 m -122.61 126.93 48.69 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.42 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 32.6 m-85 -120.15 117.05 26.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.456 -174.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.487 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 67.5 t80 -111.66 115.64 51.15 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 0.0 110.703 178.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -85.79 122.41 2.29 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.294 2.662 . . . . 0.0 112.203 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.91 138.4 41.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.752 0.31 . . . . 0.0 110.342 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.4 p -89.03 -4.28 58.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.32 0.581 . . . . 0.0 109.907 174.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.429 ' OD2' ' HD2' ' A' ' 22' ' ' LYS . 7.1 t70 -66.2 139.97 58.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.919 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -97.28 123.69 41.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.58 -174.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.429 ' HD2' ' OD2' ' A' ' 20' ' ' ASP . 5.9 mttp -155.54 158.81 39.06 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.958 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.628 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 72.6 p -70.74 167.16 19.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 174.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.727 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.6 t90 -61.07 -35.19 76.3 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.001 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -63.62 -52.23 61.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.71 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.1 -40.5 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.565 ' HB3' HD11 ' A' ' 38' ' ' LEU . 47.6 m -58.05 -40.38 80.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.288 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.437 ' HA ' HD21 ' A' ' 38' ' ' LEU . 43.9 tt0 -74.03 -26.22 60.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.12 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.4 mtm180 -79.03 -45.1 20.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.09 0.471 . . . . 0.0 110.961 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.1 -37.87 88.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.722 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.5 m -85.57 178.9 7.23 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 171.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 24.9 m 76.85 -47.19 0.52 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.903 0.481 . . . . 0.0 111.138 -178.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.53 -20.19 67.61 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.109 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.4 mtm -93.15 6.73 46.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.699 0.285 . . . . 0.0 110.573 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.1 -5.93 69.48 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.725 -175.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.42 179.43 5.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.458 -0.371 . . . . 0.0 110.701 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.727 ' HB3' HG13 ' A' ' 76' ' ' VAL . 97.3 m-70 -147.45 169.57 19.24 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 27' ' ' SER . 3.9 mm? -59.05 154.72 15.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.865 0.302 . . . . 0.0 111.283 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.949 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.7 tpt -49.77 108.47 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.458 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.595 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 70.3 p -108.15 108.04 18.93 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.283 0.563 . . . . 0.0 110.246 177.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.529 HD11 HD11 ' A' ' 104' ' ' LEU . 60.9 mt -73.42 103.09 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.453 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.4 m -77.99 -48.7 15.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.06 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 55.5 p -125.42 170.15 11.67 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.85 0.833 . . . . 0.0 111.871 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -61.82 -25.84 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.55 -41.68 72.15 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.285 177.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 43' ' ' THR . 1.9 mp0 -48.25 -54.88 12.06 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.209 0.528 . . . . 0.0 109.588 171.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.805 HE22 HD13 ' A' ' 51' ' ' ILE . 0.8 OUTLIER -55.31 -59.97 4.06 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.623 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -58.55 -40.51 83.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -173.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -84.44 -36.39 22.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.25 -33.36 57.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.824 -176.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.805 HD13 HE22 ' A' ' 47' ' ' GLN . 43.0 pt -69.99 -10.33 13.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -76.01 -33.99 59.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.926 0.394 . . . . 0.0 110.0 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.89 -25.65 24.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.552 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 80.6 mt -67.94 140.2 56.43 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.662 -178.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.534 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.3 t70 -77.4 128.84 34.95 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.571 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 82.5 mtt180 -81.04 7.42 10.88 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -167.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.928 ' HG2' HD22 ' A' ' 58' ' ' LEU . 5.0 ptp180 -103.8 -13.5 16.4 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.01 176.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.928 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -101.52 150.29 23.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.059 0.457 . . . . 0.0 110.912 179.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.1 m -107.15 124.52 49.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.624 ' HB3' HG13 ' A' ' 125' ' ' ILE . 88.6 m-85 -105.89 122.38 46.0 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -172.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.762 ' HA ' HG12 ' A' ' 103' ' ' VAL . 21.5 m-85 -59.92 140.63 56.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.633 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' HG ' ' A' ' 104' ' ' LEU . 82.4 mt -107.68 168.22 9.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.397 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -92.84 25.48 19.15 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.148 -177.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.654 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 38.7 tp -92.87 109.03 20.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HE ' ' HH2' ' A' ' 24' ' ' TRP . 13.2 ttm180 -96.34 122.07 38.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -173.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -104.59 154.26 20.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 157.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' ASN . 27.8 tt0 -135.24 95.82 3.37 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.284 -174.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 18.5 m120 78.7 -45.29 0.38 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.188 175.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' ASN . . . 165.14 -6.34 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.981 -171.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 35.1 mttp -68.09 94.03 0.47 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 172.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -69.0 72.56 0.39 Allowed Glycine 0 C--N 1.329 0.162 0 O-C-N 123.649 0.593 . . . . 0.0 113.266 -176.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -125.22 74.45 1.38 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 92.1 m95 -68.19 104.88 1.93 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.303 -175.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -134.15 152.34 51.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.164 177.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.595 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 85.5 m95 -85.88 147.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 120.256 -0.578 . . . . 0.0 109.599 177.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.727 HG13 ' HB3' ' A' ' 37' ' ' HIS . 11.3 p -77.53 -6.76 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -167.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -100.69 -60.05 1.59 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 121.334 -0.854 . . . . 0.0 111.214 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.403 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.0 OUTLIER -170.24 -21.57 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.172 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.3 m -60.33 122.07 64.48 Favored Pre-proline 0 C--O 1.24 0.592 0 CA-C-O 121.569 0.699 . . . . 0.0 111.811 -172.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.9 Cg_exo -71.12 157.31 57.91 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.223 2.615 . . . . 0.0 111.312 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -71.89 126.14 28.98 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.466 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.507 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 19.7 m-80 -96.24 106.38 28.42 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.417 179.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.03 -29.45 40.31 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.517 2.144 . . . . 0.0 112.211 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -78.98 -22.89 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.736 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 73.0 mtt180 -117.97 31.34 6.75 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.246 -171.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 86' ' ' VAL . 7.1 p -88.78 91.6 3.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 122.116 0.96 . . . . 0.0 109.661 175.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.01 68.12 9.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.366 -169.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.421 ' CD1' HG22 ' A' ' 86' ' ' VAL . 79.0 m95 -74.23 143.8 44.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 172.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 83.6 m-70 . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 171.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.8 t30 . . . . . 0 N--CA 1.471 0.596 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -154.83 160.7 41.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 173.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.461 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.3 m -107.65 148.02 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.17 0.509 . . . . 0.0 112.171 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.762 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -125.74 156.69 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.563 175.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.58 ' HG ' HD21 ' A' ' 62' ' ' LEU . 15.4 mt -86.53 118.39 25.92 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.3 p -134.81 143.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.601 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.4 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 34.5 t80 -80.56 105.72 12.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.754 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.424 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 48.1 t30 -156.81 140.03 15.57 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.155 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ASP . 41.9 mt-30 67.34 40.7 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.831 0.707 . . . . 0.0 109.688 -175.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 108' ' ' GLN . 31.2 t70 78.82 -16.22 0.69 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.493 174.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.75 170.79 15.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.477 0.656 . . . . 0.0 112.213 -174.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.571 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 72.2 m95 -88.07 130.63 34.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.539 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.587 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -153.04 171.1 18.91 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.409 ' HE1' HD12 ' A' ' 41' ' ' ILE . 26.7 m0 -78.01 131.88 37.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.554 0.534 . . . . 0.0 110.807 -173.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -121.17 127.95 52.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.087 174.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -82.8 125.69 31.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.254 0.549 . . . . 0.0 110.59 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.9 m -141.33 155.23 67.78 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.159 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.89 133.12 53.88 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.18 1.92 . . . . 0.0 111.246 172.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.727 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 66.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.181 -178.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -77.24 -7.77 56.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.427 . . . . 0.0 110.651 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -83.59 140.98 31.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -104.52 145.21 30.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.223 0.535 . . . . 0.0 111.33 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -159.8 -168.78 2.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.353 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.3 m -78.39 170.82 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.464 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 12.9 ptt180 -152.17 148.07 27.18 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.944 -171.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.3 mt -113.23 135.26 53.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.5 t -114.31 130.78 56.67 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -115.54 131.94 56.78 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.655 -175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.543 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.2 tt -127.54 138.5 32.96 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 175.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -64.48 166.32 17.79 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.048 1.832 . . . . 0.0 111.042 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.13 82.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.924 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 17.0 p -76.36 18.53 0.3 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 122.818 0.447 . . . . 0.0 111.797 -177.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -65.36 -14.41 60.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.106 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -69.69 -29.48 66.91 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.505 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.412 HD22 ' C ' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -73.48 -38.9 65.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.97 28.2 1.64 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.967 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 7.8 pt-20 -52.31 -51.65 57.43 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.374 0.421 . . . . 0.0 112.005 -175.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.434 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 28.7 p-10 -80.5 -27.53 37.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.653 0.264 . . . . 0.0 110.895 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.2 -49.78 70.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -73.54 -22.32 60.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -67.69 -33.1 74.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.084 0.469 . . . . 0.0 110.061 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.6 mt-30 -88.14 -6.17 58.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.413 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.026 -175.339 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.405 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.8 m . . . . . 0 C--O 1.234 0.241 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 52.0 Cg_exo -55.13 147.36 54.55 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.016 1.811 . . . . 0.0 111.258 172.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.14 -24.93 34.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 121.182 0.515 . . . . 0.0 110.966 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -59.7 -58.22 9.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.418 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.409 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 33.4 m95 -64.71 138.7 58.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.212 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 1.7 tpp180 -86.0 106.88 17.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.092 0.472 . . . . 0.0 110.743 -176.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.25 122.54 26.44 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.38 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.453 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 65.7 t80 -140.14 119.04 12.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 56.76 -129.6 1.78 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.111 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -88.4 -4.94 58.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.706 0.289 . . . . 0.0 111.138 -178.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -105.67 169.17 8.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.136 0.493 . . . . 0.0 111.524 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.5 m -139.6 135.54 33.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.149 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 17.4 m-85 -124.43 129.64 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.932 -172.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 40.3 t80 -116.46 114.16 40.48 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.398 175.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.2 Cg_endo -88.77 130.97 2.27 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.334 2.689 . . . . 0.0 112.4 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 123' ' ' SER . 5.8 mp -107.63 140.5 40.56 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.52 60.2 1.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.398 0.618 . . . . 0.0 112.121 -171.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 1.3 t70 82.44 -168.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.292 165.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 65.1 27.44 12.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.099 -178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -141.81 141.44 33.15 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.347 0.594 . . . . 0.0 110.962 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 p -91.94 166.2 12.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.058 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.655 ' CH2' ' HG3' ' A' ' 65' ' ' ARG . 58.7 t90 -64.91 -34.78 79.22 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.3 -177.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.58 -51.88 68.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.34 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.67 -43.49 93.97 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.185 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.536 ' HB3' HD11 ' A' ' 38' ' ' LEU . 69.0 m -55.01 -46.92 75.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.468 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -68.91 -26.05 64.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.942 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -83.66 -30.24 26.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.815 0.341 . . . . 0.0 110.989 178.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.59 -42.68 19.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.569 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.4 m -101.26 128.67 47.28 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 p 154.31 -65.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.668 1.23 . . . . 0.0 108.78 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.52 -19.37 72.75 Favored Glycine 0 C--O 1.227 -0.295 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.917 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.8 mtm -78.53 1.06 23.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.751 0.31 . . . . 0.0 110.564 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.82 -11.88 63.22 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.752 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.49 161.98 13.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.576 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.449 ' HB3' HG23 ' A' ' 76' ' ' VAL . 28.3 m-70 -130.25 170.41 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 27' ' ' SER . 4.5 mm? -56.89 148.44 20.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 173.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.77 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -46.65 106.64 0.09 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.833 0.708 . . . . 0.0 112.57 -174.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.533 HG22 ' CE3' ' A' ' 75' ' ' TRP . 24.3 p -105.9 89.08 2.97 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.182 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.69 110.85 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 110.26 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.6 m -102.34 -30.8 10.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.941 -175.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 32.0 p -131.61 155.25 47.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.461 0.648 . . . . 0.0 112.309 -177.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -62.35 -46.78 87.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.988 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.5 -39.2 79.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 43' ' ' THR . 84.1 tt0 -52.46 -57.25 10.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.673 176.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.402 ' O ' HG23 ' A' ' 51' ' ' ILE . 57.2 tt0 -61.04 -50.91 71.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.928 179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -57.22 -31.34 65.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -88.28 -36.53 16.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.1 tp -73.1 -30.25 31.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.836 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.598 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.2 pt -71.67 -4.53 4.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.063 0.459 . . . . 0.0 110.997 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -87.85 -27.26 22.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.932 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -87.91 -22.97 24.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.642 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 73.7 mt -70.54 149.93 46.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.86 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.2 m-20 -57.73 -28.34 63.79 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.928 -177.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.649 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 60.0 mtt180 64.5 20.35 12.12 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.668 0.747 . . . . 0.0 109.273 -168.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HB3' ' HB3' ' A' ' 55' ' ' ASP . 7.3 ttp180 -120.69 -21.7 6.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.076 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -117.85 169.99 9.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.7 p -107.43 122.1 45.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.257 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -104.67 120.51 41.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 -172.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.435 ' HZ ' ' O ' ' A' ' 120' ' ' PHE . 44.7 m-85 -55.19 136.97 48.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.021 0.439 . . . . 0.0 111.851 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 104' ' ' LEU . 78.0 mt -108.21 -175.07 2.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.276 177.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.447 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -96.07 11.35 67.64 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.965 -174.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.559 ' HB3' HG22 ' A' ' 102' ' ' VAL . 28.7 tp -80.05 119.44 22.88 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.655 ' HG3' ' CH2' ' A' ' 24' ' ' TRP . 31.1 ttt-85 -111.81 126.25 54.88 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -133.75 149.95 51.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.428 -0.805 . . . . 0.0 108.945 164.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 2.4 pt-20 -148.46 119.96 7.95 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.007 0.432 . . . . 0.0 110.477 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 58.01 33.97 23.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.613 176.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 67.99 80.79 0.2 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.744 0.653 . . . . 0.0 112.023 175.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 58.0 mttp -129.03 113.03 14.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.663 175.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.5 59.74 1.2 Allowed Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.088 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -137.59 70.28 1.4 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -61.13 108.66 0.93 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.966 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 55.1 mtm-85 -141.38 172.41 12.72 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.533 ' CE3' HG22 ' A' ' 40' ' ' THR . 97.4 m95 -86.11 173.29 9.95 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 174.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 37' ' ' HIS . 19.6 m -78.33 39.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 111.265 179.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 11.3 t70 -164.74 -160.16 0.49 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.441 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 22.4 tp60 -78.67 -6.44 55.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 3.5 m -74.0 120.85 83.39 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.834 -177.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 3.4 Cg_exo -78.34 155.59 28.78 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.946 2.431 . . . . 0.0 111.651 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.86 133.15 51.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.935 0.397 . . . . 0.0 110.368 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -101.44 115.55 64.88 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.67 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.88 -9.59 25.34 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.695 2.263 . . . . 0.0 112.319 177.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.426 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.1 tpp180 -110.1 1.52 18.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.161 0.505 . . . . 0.0 110.238 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.649 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 20.2 mmt180 -128.77 57.29 1.62 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.346 0.593 . . . . 0.0 110.048 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.2 p -138.25 139.67 41.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.609 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -127.51 76.4 1.67 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.716 0.293 . . . . 0.0 110.565 -177.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -67.97 -176.05 0.64 Allowed 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.655 0.741 . . . . 0.0 112.439 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 1.2 m-70 . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.478 -178.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 12.1 m120 . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 121.019 0.438 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.7 m -119.87 123.25 43.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.045 0.45 . . . . 0.0 110.398 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.2 m -80.77 135.6 24.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.068 0.461 . . . . 0.0 110.526 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.7 m -115.39 147.57 18.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.826 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 28.0 tp -83.16 101.73 11.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 175.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.3 p -121.83 145.58 28.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 -174.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.419 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 29.7 t80 -86.08 99.41 11.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.538 177.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.3 t-20 -149.48 137.28 20.33 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 92.2 mt-30 69.83 24.71 5.21 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -171.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.2 t70 71.18 -11.3 0.69 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.098 -1.41 . . . . 0.0 111.637 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HZ2' ' HB2' ' A' ' 112' ' ' ALA . 14.5 ptmm? -109.04 150.67 27.45 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.0 110.304 -178.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.649 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 95.1 m95 -77.42 130.83 37.58 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.432 ' HB2' ' HZ2' ' A' ' 110' ' ' LYS . . . -152.47 156.41 39.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.823 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.554 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 17.8 m0 -81.14 115.31 20.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.37 -178.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -107.03 133.88 51.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -77.89 124.09 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.257 0.348 . . . . 0.0 111.07 -179.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.407 HG21 ' CE1' ' A' ' 120' ' ' PHE . 3.3 m -149.56 158.52 37.71 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.974 176.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -60.89 137.32 71.66 Favored 'Trans proline' 0 CA--C 1.531 0.338 0 C-N-CA 122.282 1.988 . . . . 0.0 111.787 175.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.554 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 41.8 m -64.67 -23.85 67.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.39 15.14 18.42 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.023 -0.423 . . . . 0.0 111.169 -174.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.495 ' CZ ' ' HB2' ' A' ' 122' ' ' ALA . 0.1 OUTLIER -84.55 140.42 31.43 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.91 128.45 35.54 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.788 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.495 ' HB2' ' CZ ' ' A' ' 120' ' ' PHE . . . -161.87 -169.24 2.16 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.242 0.544 . . . . 0.0 111.261 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.544 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 14.5 m -96.6 -176.58 3.65 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.615 177.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.455 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 13.9 ptt-85 -165.41 170.08 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.045 0.45 . . . . 0.0 111.35 177.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.0 mt -122.35 135.73 61.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 6.1 t -103.43 129.16 50.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -111.95 113.08 25.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.823 -171.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.752 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.5 tt -124.85 138.78 32.04 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-O 120.867 0.365 . . . . 0.0 110.883 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -70.08 167.54 24.58 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 123.15 2.567 . . . . 0.0 111.99 170.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.56 93.37 0.14 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.715 174.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.3 p -78.21 33.22 0.19 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 21.4 p -67.36 -17.13 64.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.996 0.427 . . . . 0.0 110.837 176.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 78.9 mt -73.38 -18.14 61.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.568 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -88.67 -56.52 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 110.071 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.58 29.05 1.36 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.297 -175.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -63.12 -55.81 22.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -175.788 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.45 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 5.3 p30 -80.86 -22.84 39.54 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.31 -39.48 93.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.394 177.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -81.6 -30.78 32.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.31 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -67.73 -31.2 70.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.755 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -86.76 -5.41 59.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.74 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.36 -175.657 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 65.3 m . . . . . 0 C--O 1.233 0.234 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 51.9 Cg_exo -53.83 148.53 37.03 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.057 1.838 . . . . 0.0 111.453 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.82 -29.93 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.925 0.393 . . . . 0.0 111.356 -172.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.09 -29.91 71.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.692 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 23.6 m95 -88.26 125.83 34.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.583 -174.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 8' ' ' ARG . 16.6 tpt180 -73.6 99.86 3.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.195 0.522 . . . . 0.0 110.063 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.37 129.46 39.83 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.86 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.435 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 85.9 t80 -132.69 105.79 7.39 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.426 177.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 56.96 -103.57 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.786 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.2 t -91.25 -37.94 12.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.626 -177.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -92.65 174.33 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.136 0.493 . . . . 0.0 111.729 -173.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HB2' HG22 ' A' ' 128' ' ' ILE . 78.2 m -141.2 127.5 19.79 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.407 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.435 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 53.7 m-85 -120.58 127.25 51.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.386 -171.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.8 t80 -117.94 114.66 37.17 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.781 0.324 . . . . 0.0 110.408 176.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 5.2 Cg_endo -88.11 128.01 2.22 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.247 2.631 . . . . 0.0 112.075 176.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.05 138.57 48.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.009 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 p -89.43 2.69 54.14 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.527 0.68 . . . . 0.0 109.408 173.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 22' ' ' LYS . 3.9 t70 -66.48 133.52 50.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.002 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.703 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 16.5 p-10 -93.09 107.03 18.91 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.849 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.936 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 14.4 mptt -136.83 156.08 48.96 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.833 177.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 76.4 p -76.46 167.57 21.61 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.653 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.5 t90 -58.89 -39.2 80.73 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.941 0.4 . . . . 0.0 110.771 -176.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.09 76.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.186 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.97 -34.48 77.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.044 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.9 t -58.45 -46.33 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.866 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -74.9 -22.46 58.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.76 0.314 . . . . 0.0 110.39 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -67.66 -45.81 74.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.782 0.325 . . . . 0.0 110.744 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.407 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.7 t-20 -71.97 -28.7 63.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.201 0.524 . . . . 0.0 109.949 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.52 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 65.3 m -84.13 177.13 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.41 ' HB3' ' O ' ' A' ' 31' ' ' CYS . 33.2 t 75.33 -34.82 0.26 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.017 0.527 . . . . 0.0 110.919 -177.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.67 -29.27 71.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.97 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.52 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.5 pmm? -100.47 10.51 41.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.331 . . . . 0.0 110.368 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.75 19.82 67.17 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.524 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.829 ' HB2' HG12 ' A' ' 128' ' ' ILE . . . -113.79 172.77 6.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.658 0.266 . . . . 0.0 111.39 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.468 ' HD2' ' OD1' ' A' ' 77' ' ' ASP . 71.3 m-70 -140.48 169.2 18.11 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' HG23 ' A' ' 40' ' ' THR . 4.1 mm? -52.44 141.02 20.86 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.371 0.419 . . . . 0.0 110.922 173.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.572 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.8 tpt -36.26 111.15 0.13 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.145 0.903 . . . . 0.0 112.439 177.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.647 HG21 ' HB3' ' A' ' 77' ' ' ASP . 12.0 p -111.89 89.01 2.94 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.522 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.567 ' HA ' ' OE2' ' A' ' 46' ' ' GLU . 41.9 mt -64.65 114.83 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.486 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m -106.9 -22.78 12.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.832 -177.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.597 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 13.1 p -132.96 151.9 52.0 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.362 1.077 . . . . 0.0 113.182 -178.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.96 -50.63 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.548 -179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -59.36 -39.41 83.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.542 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' ' 43' ' ' THR . 61.8 tt0 -48.5 -58.93 3.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.183 176.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.505 ' HA ' HG22 ' A' ' 50' ' ' ILE . 23.0 tt0 -61.18 -44.66 96.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.932 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -61.96 -25.42 67.6 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -177.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 27.5 m-85 -88.53 -37.81 15.42 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.3 tp -71.88 -30.01 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 120.381 -0.528 . . . . 0.0 111.103 -176.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.465 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.8 pt -69.44 -5.79 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.032 0.444 . . . . 0.0 111.196 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -87.22 -25.29 24.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.211 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -92.97 -23.81 18.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.494 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.7 mt -76.55 144.43 39.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.043 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.556 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -78.65 138.2 38.19 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.56 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 84.8 mtt180 -83.46 11.68 6.63 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -170.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.859 ' HG2' HD22 ' A' ' 58' ' ' LEU . 7.3 ptp180 -112.11 -11.08 13.84 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.755 176.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.859 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -100.22 166.91 10.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.271 0.558 . . . . 0.0 111.609 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.3 m -127.17 124.09 38.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.035 175.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.702 ' HB3' HG13 ' A' ' 125' ' ' ILE . 80.6 m-85 -109.07 121.95 46.23 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -169.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.463 ' HA ' HG12 ' A' ' 103' ' ' VAL . 19.1 m-85 -62.38 138.94 58.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.725 0.297 . . . . 0.0 111.791 177.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.626 HD23 HG12 ' A' ' 102' ' ' VAL . 1.4 mm? -110.92 173.36 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 174.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.641 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -87.73 60.65 4.19 Favored Glycine 0 C--O 1.225 -0.414 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.315 -177.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.461 HD23 ' HB ' ' A' ' 102' ' ' VAL . 3.3 mm? -109.55 126.42 53.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.724 0.262 . . . . 0.0 110.329 177.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.504 ' NH1' ' HB3' ' A' ' 67' ' ' GLU . 16.5 ttp85 -110.87 117.53 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.422 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -136.49 84.85 2.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.982 0.896 . . . . 0.0 108.998 164.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NH1' ' A' ' 65' ' ' ARG . 3.3 tm-20 -91.15 123.82 34.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.499 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.404 ' HB3' ' NZ ' ' A' ' 70' ' ' LYS . 3.2 t-20 71.28 19.94 5.19 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.867 0.73 . . . . 0.0 110.191 178.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.37 75.14 0.33 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.127 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 52.0 mttp -101.95 -22.56 14.27 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.654 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 -8.17 62.79 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.568 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -86.07 65.14 8.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.554 0.692 . . . . 0.0 110.289 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -61.16 113.82 2.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.177 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -133.32 151.01 51.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.737 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 75.4 m95 -84.61 136.96 33.55 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.439 HG21 ' CZ2' ' A' ' 24' ' ' TRP . 10.5 t -79.2 47.98 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.662 0.744 . . . . 0.0 110.809 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.647 ' HB3' HG21 ' A' ' 40' ' ' THR . 33.9 t70 -162.09 32.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -178.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.76 -37.29 0.28 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.279 -1.328 . . . . 0.0 111.586 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 24.2 m -43.26 122.29 3.27 Favored Pre-proline 0 C--O 1.239 0.505 0 CA-C-O 121.531 0.681 . . . . 0.0 112.664 -176.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.8 Cg_exo -72.04 148.15 50.27 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 123.309 2.673 . . . . 0.0 111.644 174.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 75' ' ' TRP . 68.0 t80 -69.86 127.91 34.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.253 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.473 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 0.9 OUTLIER -89.65 115.98 65.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.347 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.65 -29.15 36.73 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.63 2.22 . . . . 0.0 112.651 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -90.09 -22.56 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.802 0.334 . . . . 0.0 111.249 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.473 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 86.4 mtt180 -105.92 76.91 1.21 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.512 0.673 . . . . 0.0 110.484 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.0 p -136.41 131.02 47.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.944 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -126.39 52.05 1.76 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.909 -168.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.425 ' CH2' HG22 ' A' ' 102' ' ' VAL . 85.8 m95 -64.81 177.95 0.87 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.454 0.645 . . . . 0.0 111.372 178.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.495 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 91.0 m-70 . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.536 172.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.493 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.2 p-10 . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 121.529 0.68 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.37 166.34 28.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.464 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.626 HG12 HD23 ' A' ' 62' ' ' LEU . 59.1 t -95.71 139.88 18.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -169.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.6 m -123.9 141.45 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.718 168.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.51 ' N ' HD21 ' A' ' 62' ' ' LEU . 13.9 tp -81.53 109.99 16.5 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.38 140.46 49.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.57 -172.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.56 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 66.5 t80 -88.25 96.09 10.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.495 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 49.5 t-20 -129.33 128.53 43.31 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -176.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 61.45 38.79 15.67 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.856 0.722 . . . . 0.0 109.987 -175.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 10.5 m-20 65.56 16.9 10.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.246 -1.343 . . . . 0.0 113.15 174.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HE2' ' HB2' ' A' ' 110' ' ' LYS . 10.9 ptmm? -132.49 137.09 47.08 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.903 172.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.465 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -70.8 130.35 41.46 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 170.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -157.0 168.81 26.38 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.471 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.404 ' HB3' HG13 ' A' ' 102' ' ' VAL . 37.0 m0 -79.15 142.16 36.61 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.292 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -136.25 122.17 20.04 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 13.5 t70 -84.17 123.6 30.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.702 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.449 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 21.3 m -139.23 159.94 64.27 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.458 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.476 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 13.1 Cg_endo -57.38 131.32 44.04 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.53 2.153 . . . . 0.0 111.942 175.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 69.5 m -67.19 -12.75 60.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.19 0.519 . . . . 0.0 110.657 177.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -85.77 -2.78 58.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.55 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.476 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 83.5 t80 -88.0 138.35 31.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.109 175.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.96 135.91 33.73 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.906 0.384 . . . . 0.0 110.252 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.441 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -154.14 -173.21 4.49 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.969 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 39.2 m -74.29 160.45 31.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.985 0.421 . . . . 0.0 110.088 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.936 ' HD2' ' HB2' ' A' ' 22' ' ' LYS . 48.4 mtp180 -127.26 145.85 50.63 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.587 -169.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.702 HG13 ' HB3' ' A' ' 60' ' ' TYR . 59.0 mt -124.65 119.63 56.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 166.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.54 132.8 53.47 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -112.91 126.54 55.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.075 0.464 . . . . 0.0 111.961 -174.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.829 HG12 ' HB2' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -111.38 134.74 21.09 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.941 175.562 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HD13 ' A' ' 128' ' ' ILE . 6.6 Cg_exo -74.11 158.63 45.35 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.113 1.875 . . . . 0.0 111.164 173.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.41 49.59 2.33 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.9 t -111.12 18.08 19.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.08 0.467 . . . . 0.0 110.521 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.2 m -60.53 -21.91 63.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.227 0.536 . . . . 0.0 111.258 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 133' ' ' LEU . 3.9 mp -75.91 -28.9 58.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.102 179.121 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -87.82 -43.17 12.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.871 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -85.79 61.13 6.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.172 -177.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -43.37 74.2 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.2 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -74.8 -30.08 61.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.563 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tt -64.91 -45.28 86.53 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.82 -30.55 71.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.278 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -71.95 -35.64 69.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.812 178.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -86.64 -6.11 58.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.998 -176.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.252 1.226 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.785 -177.618 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.754 ' SG ' ' HD2' ' A' ' 4' ' ' PRO . 3.0 t . . . . . 0 N--CA 1.452 -0.329 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.754 ' HD2' ' SG ' ' A' ' 3' ' ' CYS . 18.5 Cg_endo -64.96 119.42 6.45 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 N-CA-C 108.859 -1.247 . . . . 0.0 108.859 164.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.411 HG22 ' N ' ' A' ' 6' ' ' ASP . 5.3 mp 60.19 159.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -166.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.411 ' N ' HG22 ' A' ' 5' ' ' ILE . 10.7 t70 -79.96 72.76 6.74 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.117 -0.989 . . . . 0.0 110.394 -177.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.454 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 10.4 m0 -73.23 155.34 39.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.179 174.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 8' ' ' ARG . 18.3 tpt180 -72.87 102.07 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.067 0.461 . . . . 0.0 110.063 -177.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -87.19 124.91 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.112 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.47 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 66.9 t80 -120.36 110.98 17.18 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.177 174.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 66.88 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.101 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -149.07 17.33 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.926 0.393 . . . . 0.0 110.625 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.481 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 36.8 m-80 -125.92 151.01 47.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.463 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.758 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 80.3 m -106.25 135.03 48.45 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.325 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 27.7 m-85 -129.24 134.72 48.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.511 ' HD2' HD22 ' A' ' 18' ' ' LEU . 8.4 t80 -123.73 113.23 28.77 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.9 Cg_endo -89.68 118.35 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.533 2.822 . . . . 0.0 111.858 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -132.24 140.47 48.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.371 0.605 . . . . 0.0 110.389 178.373 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 p -86.99 5.29 38.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.299 -169.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 18' ' ' LEU . 2.8 m-20 -59.56 135.04 57.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.052 0.453 . . . . 0.0 110.174 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.676 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 2.1 p-10 -96.28 102.3 14.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.022 -176.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.676 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 13.4 mmmt -137.07 155.52 49.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 179.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.7 p -70.72 178.98 2.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.834 -176.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.559 ' CZ2' HG23 ' A' ' 76' ' ' VAL . 49.4 t90 -56.54 -52.7 63.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.12 0.486 . . . . 0.0 110.444 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.633 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -67.04 -43.72 82.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.293 -177.294 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.28 -31.54 64.13 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -174.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 p -67.26 -35.26 79.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.581 175.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' HB2' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -66.25 -30.98 71.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.739 173.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.633 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 11.1 mmt-85 -83.24 -25.59 31.55 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.105 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -77.61 -26.39 50.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.7 m -85.87 178.88 7.15 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 166.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.743 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 6.9 p 81.39 -41.23 0.15 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.79 0.836 . . . . 0.0 111.565 172.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.81 -23.09 58.49 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 116.202 -0.454 . . . . 0.0 113.008 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -100.62 15.73 27.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.658 0.266 . . . . 0.0 110.914 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.18 47.59 7.43 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.2 -175.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -142.98 -174.37 4.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.835 0.35 . . . . 0.0 110.649 -173.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.653 ' CD2' ' HB2' ' A' ' 77' ' ' ASP . 9.6 t60 -148.48 162.16 40.18 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 171.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 28' ' ' GLU . 21.9 tp -56.95 145.73 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.4 113.67 2.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.542 0.686 . . . . 0.0 112.443 -173.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -106.92 109.71 21.67 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.252 170.164 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.2 mt -64.6 111.68 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.975 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.1 m -97.16 -31.65 12.35 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.787 -174.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 21.9 p -128.04 153.27 46.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.85 0.833 . . . . 0.0 112.433 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.443 ' CG ' ' HG2' ' A' ' 85' ' ' ARG . 19.3 mt-10 -66.69 -36.12 81.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.965 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.11 79.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.033 0.444 . . . . 0.0 110.425 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.565 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.8 tt0 -55.58 -54.54 42.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.42 ' O ' HG23 ' A' ' 51' ' ' ILE . 21.5 tm0? -57.74 -48.86 78.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.641 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -64.02 -27.73 69.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.277 -176.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -89.23 -41.24 12.32 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.9 tp -62.51 -35.52 70.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 -176.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.65 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 41.5 pt -68.1 -9.22 10.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.497 -178.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -82.81 -30.0 29.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.24 -28.8 25.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.694 -178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 69.4 mt -62.86 158.02 20.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.505 ' OD2' ' HB3' ' A' ' 57' ' ' ARG . 15.8 t70 -78.88 -2.45 39.92 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.994 -1.003 . . . . 0.0 112.975 -171.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.719 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 10.9 mpt_? 64.94 -57.51 0.27 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -172.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HB3' ' OD2' ' A' ' 55' ' ' ASP . 13.5 ttp180 -61.99 -27.73 69.07 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 122.982 0.513 . . . . 0.0 111.864 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.51 147.32 24.04 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.367 0.603 . . . . 0.0 112.243 -175.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.9 m -100.93 130.54 46.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.72 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 123' ' ' SER . 86.2 m-85 -112.94 124.34 52.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -174.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -69.99 127.93 34.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.033 174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.562 HD21 ' HB2' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -169.71 -177.48 2.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.648 179.334 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.414 ' HA2' ' CZ3' ' A' ' 75' ' ' TRP . . . 83.77 -115.03 3.98 Favored Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 115.23 0.852 . . . . 0.0 115.23 163.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 75' ' ' TRP . 3.2 mm? -93.67 154.32 17.88 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.132 -0.534 . . . . 0.0 110.577 -170.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.456 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 14.0 ttm180 -93.6 104.33 16.45 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.72 ' HB2' ' HA ' ' A' ' 101' ' ' CYS . 5.4 m-20 -97.0 75.4 2.64 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.993 0.902 . . . . 0.0 108.778 178.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 13.8 tt0 -112.39 121.16 44.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 114.574 -1.193 . . . . 0.0 110.624 -171.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 67.86 15.87 9.61 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.469 0.48 . . . . 0.0 110.688 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.91 35.1 24.85 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.492 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 23.8 mttm -64.46 137.21 57.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.407 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -68.59 -15.32 68.38 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.064 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -86.95 86.0 7.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.693 ' HZ3' ' HA ' ' A' ' 66' ' ' ASP . 71.9 m95 -75.54 133.7 40.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.09 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.568 HH21 ' HA ' ' A' ' 78' ' ' GLN . 73.2 ttt180 -150.47 149.11 29.56 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.502 ' HA ' HD13 ' A' ' 64' ' ' LEU . 78.0 m95 -69.66 169.92 11.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.34 0.591 . . . . 0.0 111.01 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 40' ' ' THR . 8.8 p -62.57 -19.31 22.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.714 -178.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.653 ' HB2' ' CD2' ' A' ' 37' ' ' HIS . 20.5 t70 -147.67 103.57 3.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.471 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.568 ' HA ' HH21 ' A' ' 74' ' ' ARG . 45.4 tp60 64.88 -64.68 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 7.4 m -42.99 127.89 3.25 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 124.206 1.002 . . . . 0.0 112.963 -173.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.7 Cg_exo -74.89 159.68 41.44 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.087 2.525 . . . . 0.0 111.687 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -54.64 133.07 46.57 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.752 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.462 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 11.0 t-20 -103.97 128.4 27.29 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.658 -175.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.3 Cg_exo -67.92 -36.25 18.46 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.01 2.474 . . . . 0.0 113.904 -177.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 33.0 ttp180 -96.13 -34.73 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.623 -176.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.443 ' HG2' ' CG ' ' A' ' 44' ' ' GLU . 95.8 mtt180 -93.14 25.4 3.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.301 0.572 . . . . 0.0 110.814 -172.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 86' ' ' VAL . 6.0 p -90.88 95.39 5.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.978 0.894 . . . . 0.0 109.619 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.25 73.36 10.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.291 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 25.5 m95 -66.75 166.64 12.73 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.499 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.586 ' NE2' ' HB3' ' A' ' 107' ' ' ASN . 6.2 t-80 . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.537 -172.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.677 ' HB2' ' OD2' ' A' ' 115' ' ' ASP . 4.6 p-10 . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.111 0.482 . . . . 0.0 110.311 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.72 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 93.2 m -46.86 131.21 11.99 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.077 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.84 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 10.4 m -80.14 144.17 11.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.582 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.647 HG11 ' HE1' ' A' ' 120' ' ' PHE . 28.0 m -130.62 150.01 34.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.787 170.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.562 ' HB2' HD21 ' A' ' 62' ' ' LEU . 14.7 tp -83.88 110.53 18.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 11.1 p -134.46 152.31 33.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 -176.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.711 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 20.0 t80 -87.61 96.85 10.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.649 177.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.586 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 57.6 t30 -133.65 145.59 50.11 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 63.89 16.06 9.57 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.432 0.457 . . . . 0.0 110.414 -176.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.8 t70 78.0 19.55 1.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.136 0.897 . . . . 0.0 111.624 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' HE3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -141.74 156.29 45.61 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.391 -0.818 . . . . 0.0 111.599 173.643 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.719 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.7 m95 -85.54 128.54 34.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.716 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -165.27 174.46 10.16 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.64 175.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.84 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 30.3 m0 -80.17 124.48 28.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.97 0.414 . . . . 0.0 111.165 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.423 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 8.0 t-20 -99.55 142.25 31.27 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.372 176.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.677 ' OD2' ' HB2' ' A' ' 100' ' ' ASN . 14.4 t70 -84.84 122.65 29.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.418 HG21 ' CE1' ' A' ' 120' ' ' PHE . 0.6 OUTLIER -151.27 149.04 23.66 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 111.54 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 120' ' ' PHE . 8.2 Cg_endo -53.01 144.84 44.06 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.883 2.389 . . . . 0.0 111.52 172.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 26.4 m -81.97 -14.41 56.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.576 -170.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -80.4 -8.95 59.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.459 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.647 ' HE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -74.07 133.62 42.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 170.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -112.73 146.26 39.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.471 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.451 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.45 -168.6 3.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.365 -176.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 8.5 t -69.35 166.66 18.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.696 HH11 ' HB2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -153.35 161.84 41.91 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -168.152 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.417 HD11 HD21 ' A' ' 54' ' ' LEU . 68.1 mt -136.55 133.94 49.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.101 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 75.8 m -102.6 142.25 34.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 173.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -121.81 136.01 54.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.852 0.358 . . . . 0.0 110.807 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.758 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 56.2 mt -125.23 135.28 26.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.754 177.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.19 157.21 29.94 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.065 1.843 . . . . 0.0 111.45 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.24 58.19 1.92 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.464 179.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.0 t -69.26 -20.9 63.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 111.568 0.211 . . . . 0.0 111.568 -176.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.6 m -66.09 -26.54 67.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.142 0.496 . . . . 0.0 110.617 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.441 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.8 mp -90.32 -20.84 22.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.368 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.01 -28.46 22.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.429 0.633 . . . . 0.0 109.35 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.67 39.31 0.95 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.716 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -64.32 -49.56 71.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.851 -174.699 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -83.2 -26.8 30.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.011 0.434 . . . . 0.0 110.267 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 58.1 mt -62.54 -52.59 62.85 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.601 178.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -75.05 -19.3 60.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.279 0.562 . . . . 0.0 110.057 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.02 -39.71 95.56 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -87.76 -44.53 11.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.271 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.46 -177.764 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.2 m . . . . . 0 C--O 1.234 0.253 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . 0.446 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 41.1 Cg_exo -57.27 149.15 66.28 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.489 2.126 . . . . 0.0 112.155 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.74 -14.84 18.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.403 0.621 . . . . 0.0 111.132 -176.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.7 -30.61 67.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.262 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.553 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 23.0 m95 -90.96 161.47 15.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.015 -173.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 50.3 mmt-85 -115.7 136.19 53.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.931 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -102.91 135.83 43.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.916 0.389 . . . . 0.0 111.579 -176.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.45 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 73.6 t80 -137.97 110.18 7.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.621 175.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 66.0 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.209 -176.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.6 m -151.92 30.19 0.57 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.268 0.556 . . . . 0.0 109.759 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.471 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 17.7 m-80 -129.02 149.9 50.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.384 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 85.5 m -124.89 127.14 46.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 109.928 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.45 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 5.6 m-85 -117.0 141.59 48.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.194 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.553 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 26.4 t80 -128.74 114.9 19.25 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-O 120.73 0.3 . . . . 0.0 110.367 175.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -88.79 138.41 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.998 2.465 . . . . 0.0 112.23 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.45 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 5.1 mp -122.48 149.66 43.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.093 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 20' ' ' ASP . 2.6 p -101.16 66.29 1.12 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.886 -167.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.448 ' HA ' ' C ' ' A' ' 122' ' ' ALA . 32.0 t70 81.42 178.39 0.08 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.708 165.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 0.5 OUTLIER 86.57 15.23 0.11 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.569 1.147 . . . . 0.0 112.326 174.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.837 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 70.0 mmtt -139.28 148.23 42.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.95 0.405 . . . . 0.0 111.376 176.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.6 p -85.17 172.2 11.39 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 75.4 t90 -62.16 -39.96 94.37 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.09 -58.14 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.229 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.837 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 52.2 mm-40 -56.7 -37.75 71.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.538 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.556 ' HB3' HD21 ' A' ' 38' ' ' LEU . 71.7 m -54.59 -50.73 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.538 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 31' ' ' CYS . 9.0 tp10 -81.11 -21.66 39.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.737 0.303 . . . . 0.0 110.767 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 99.2 mtt180 -65.67 -42.98 90.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.074 0.464 . . . . 0.0 110.066 172.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -74.59 -28.22 60.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.226 178.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 81.4 m -84.33 178.54 7.73 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.2 m 71.78 -45.66 0.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.67 0.388 . . . . 0.0 111.077 -174.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.96 -18.39 70.66 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.2 -0.524 . . . . 0.0 111.965 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.6 mtm -97.99 3.82 49.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.329 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.9 89.45 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.89 -0.672 . . . . 0.0 111.891 -175.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -100.36 -176.58 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.722 -0.239 . . . . 0.0 110.873 -178.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -149.31 165.09 33.02 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 27' ' ' SER . 33.2 mt -60.32 144.81 49.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.069 0.461 . . . . 0.0 111.442 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.431 ' CE ' HG12 ' A' ' 41' ' ' ILE . 0.5 OUTLIER -57.79 120.02 7.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.982 -175.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.535 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 53.9 p -116.86 101.91 8.94 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.646 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.431 HG12 ' CE ' ' A' ' 39' ' ' MET . 39.2 mt -64.8 109.2 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.212 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 m -95.78 -37.83 10.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.462 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.9 p -125.66 154.09 42.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.545 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -68.39 -30.23 69.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.447 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.38 -47.27 86.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.198 175.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -53.18 -47.35 68.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.277 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -60.82 -53.57 55.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.15 176.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -57.81 -31.02 66.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.433 -174.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.447 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 34.1 m-85 -82.56 -39.24 22.56 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.7 tp -73.28 -32.22 36.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.576 -0.45 . . . . 0.0 111.35 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.428 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 34.6 pt -69.34 -9.07 11.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.478 . . . . 0.0 111.234 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -78.64 -27.42 45.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.161 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -91.51 -27.67 18.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.801 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.0 mt -68.95 134.32 49.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.663 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.436 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.7 t70 -61.5 128.74 37.78 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 171.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.554 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 64.9 mtt180 -85.48 32.02 0.58 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -168.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.855 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.0 ptp180 -127.03 -24.45 3.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.507 174.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.855 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -86.31 162.3 18.3 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.277 0.561 . . . . 0.0 112.074 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.434 ' HB2' HG21 ' A' ' 103' ' ' VAL . 4.6 p -112.55 112.74 24.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 174.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 125' ' ' ILE . 62.7 m-85 -99.36 120.74 40.07 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.715 ' HA ' HG12 ' A' ' 103' ' ' VAL . 24.3 m-85 -59.12 128.99 39.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.071 0.462 . . . . 0.0 111.734 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.821 HD11 ' HG ' ' A' ' 104' ' ' LEU . 98.9 mt -103.53 157.43 17.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.194 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.604 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -78.98 39.39 2.03 Favored Glycine 0 C--O 1.223 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 113.333 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.642 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.2 tp -105.04 116.35 31.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.414 0.607 . . . . 0.0 109.621 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.3 ttt85 -115.03 127.73 55.83 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -172.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -122.91 107.37 11.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.695 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.4 tt0 -99.71 118.73 36.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.679 -172.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.0 m120 69.0 21.5 7.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.431 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.94 70.07 0.68 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.687 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.695 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 61.1 mttp -91.59 -16.77 26.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.949 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.77 12.63 82.8 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -109.43 74.99 0.92 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.058 -0.571 . . . . 0.0 109.656 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.641 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.7 m95 -66.68 104.23 1.26 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 178.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -123.68 144.62 49.53 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 -174.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TRP . . . . . 0.604 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 89.8 m95 -85.99 131.66 34.23 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.1 p -57.82 -27.92 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.989 -175.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.515 ' HB3' HG21 ' A' ' 40' ' ' THR . 2.3 t70 -55.92 -62.43 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.039 173.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.437 ' HB2' ' O ' ' A' ' 77' ' ' ASP . 21.8 tm0? 163.44 -29.89 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.6 m -42.08 121.74 2.48 Favored Pre-proline 0 C--O 1.235 0.333 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.09 -178.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 23.7 Cg_exo -66.96 161.28 43.2 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.647 2.231 . . . . 0.0 111.385 173.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 56.5 t80 -69.02 142.46 54.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.833 -178.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.481 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 45.0 m-80 -103.1 96.84 8.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.305 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 17.7 Cg_exo -67.33 -29.85 37.75 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.519 2.146 . . . . 0.0 111.539 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -81.04 -11.66 59.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.629 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ARG . . . . . 0.481 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 92.2 mtt180 -129.44 55.51 1.76 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.176 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.73 138.06 27.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.924 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -130.77 71.6 1.47 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.298 -177.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -75.84 168.95 19.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.47 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 3.9 m-70 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.024 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.38 0.61 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.11 148.24 28.06 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.306 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 64' ' ' LEU . 20.9 m -88.56 147.21 5.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.209 0.528 . . . . 0.0 111.344 -176.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.715 HG12 ' HA ' ' A' ' 61' ' ' PHE . 34.5 m -118.59 152.76 20.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.411 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.821 ' HG ' HD11 ' A' ' 62' ' ' LEU . 17.4 mt -83.09 103.41 12.5 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.01 138.34 53.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.488 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -87.71 96.52 10.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.478 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASN . . . . . 0.47 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 62.2 t30 -140.88 147.17 38.49 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 64.4 24.25 13.15 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.648 0.593 . . . . 0.0 109.705 -172.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 66.59 22.6 10.5 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.315 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -134.41 151.31 51.11 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.969 -0.457 . . . . 0.0 111.199 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TRP . . . . . 0.554 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 81.9 m95 -88.71 108.6 19.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.509 171.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -143.45 165.76 26.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.93 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.582 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.3 m0 -78.0 125.67 29.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.39 -177.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -121.99 125.7 46.9 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 172.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 20.0 t70 -84.17 128.08 34.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.213 0.53 . . . . 0.0 111.744 -173.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.59 159.03 69.21 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.552 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.57 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.4 Cg_endo -55.85 137.93 80.23 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.384 2.056 . . . . 0.0 111.929 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 90.1 m -69.74 -9.1 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -178.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -98.85 13.24 33.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.627 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.57 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 61.9 t80 -89.08 140.36 29.53 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.611 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -82.57 125.13 30.81 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 177.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.569 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -157.49 -167.25 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.044 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 20.0 m -84.46 175.04 9.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 1.1 ptm180 -154.83 155.43 34.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.761 0.315 . . . . 0.0 111.733 -173.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.566 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.2 mt -127.9 123.82 61.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.9 t -106.53 134.84 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -119.09 125.76 50.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.94 -177.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ILE . . . . . 0.445 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 11.0 tt -112.08 141.39 24.86 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -68.51 146.5 68.18 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 121.886 1.724 . . . . 0.0 111.029 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.54 63.12 1.87 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.712 176.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.0 t -80.92 22.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.813 0.816 . . . . 0.0 110.946 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.518 ' O ' ' HB3' ' A' ' 136' ' ' GLU . 5.9 t -66.99 -11.25 56.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.385 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.793 HD23 ' H ' ' A' ' 133' ' ' LEU . 1.9 pt? -74.38 -41.35 61.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.333 0.587 . . . . 0.0 109.989 176.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . 0.415 ' N ' ' HG ' ' A' ' 133' ' ' LEU . 9.8 t30 -87.83 -46.77 9.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.869 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.02 21.0 3.89 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 132' ' ' THR . 0.0 OUTLIER -58.58 -59.32 5.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.738 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 6.5 p30 -71.86 -26.69 62.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.122 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.95 -48.32 76.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -70.99 -25.58 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.146 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -70.32 -39.66 74.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.866 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.6 mm-40 -75.11 -7.37 53.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.366 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.669 177.582 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.485 1.288 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.413 HG13 ' HB ' ' A' ' 132' ' ' THR . 4.4 p -103.88 118.51 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 170.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 78.4 m -148.05 156.45 43.69 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.724 -173.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.457 ' O ' ' HD1' ' A' ' 7' ' ' TRP . 59.6 Cg_endo -73.23 128.44 12.94 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.696 2.264 . . . . 0.0 114.752 -172.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mt 65.15 -98.11 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 114.802 -1.09 . . . . 0.0 113.735 167.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -114.56 9.79 16.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 111.849 -164.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.564 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.5 m95 -68.29 119.7 13.25 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 175.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.508 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 52.7 mmt-85 -72.68 112.11 8.43 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.689 0.281 . . . . 0.0 110.77 -175.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -77.83 121.64 24.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.408 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 77.9 t80 -139.72 121.69 15.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 60.02 -99.57 0.09 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.398 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -120.05 -11.92 9.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.93 0.395 . . . . 0.0 110.492 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -97.46 174.14 6.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.911 -174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.564 ' HB3' ' HB3' ' A' ' 7' ' ' TRP . 79.5 m -137.79 131.34 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.505 175.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.408 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 46.3 m-85 -120.62 123.86 43.84 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.872 -174.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 75.5 t80 -118.53 116.95 34.76 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.177 178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.5 Cg_endo -84.93 135.33 5.56 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.156 2.571 . . . . 0.0 112.358 178.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.7 mp -122.73 139.35 54.07 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 177.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 p -108.03 22.83 15.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.13 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -87.47 170.32 11.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.123 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -96.04 115.92 28.17 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.398 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.411 ' HA ' ' OE2' ' A' ' 121' ' ' GLU . 3.5 mmpm? -148.31 146.58 28.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.8 p -73.99 167.44 21.51 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.623 ' CH2' ' HB2' ' A' ' 65' ' ' ARG . 57.9 t90 -65.96 -35.14 79.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.54 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.97 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HA ' ' HB3' ' A' ' 29' ' ' ARG . 31.8 mt-10 -76.86 -32.03 57.22 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.533 ' HB2' HD21 ' A' ' 38' ' ' LEU . 7.1 p -68.55 -39.6 81.03 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.576 177.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.9 -33.67 76.37 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.067 0.46 . . . . 0.0 109.926 173.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.46 ' HB3' ' HA ' ' A' ' 26' ' ' GLU . 8.2 ttt180 -73.03 -42.05 63.57 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.099 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.48 -32.0 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.246 0.546 . . . . 0.0 109.999 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 87.9 m -84.82 178.15 7.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 170.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.665 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 40.2 m 75.86 -44.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.729 0.412 . . . . 0.0 111.061 -177.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.96 -23.9 66.27 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.086 -0.578 . . . . 0.0 111.955 173.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -91.05 7.27 41.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.688 0.28 . . . . 0.0 110.608 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 3.13 90.7 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.44 -175.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.665 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -101.44 -176.39 3.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.344 -0.428 . . . . 0.0 111.026 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.74 ' CD2' ' HA ' ' A' ' 77' ' ' ASP . 57.9 m-70 -143.76 170.66 15.45 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 174.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.533 HD21 ' HB2' ' A' ' 27' ' ' SER . 61.1 mt -68.15 163.12 23.32 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.275 -0.57 . . . . 0.0 110.264 174.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.958 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.4 tpt -53.85 102.33 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.27 0.557 . . . . 0.0 111.799 -177.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.585 HG22 ' HB3' ' A' ' 75' ' ' TRP . 18.3 p -105.55 104.95 14.77 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.127 178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 55.5 mt -74.8 95.32 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.892 -175.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.98 -41.26 36.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.868 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 44.9 p -123.65 161.18 25.58 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.907 0.861 . . . . 0.0 111.675 179.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -66.93 -16.47 64.35 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.876 175.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.862 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -79.67 -38.23 34.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.215 174.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -48.38 -49.37 34.89 Favored 'General case' 0 CA--C 1.521 -0.162 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.45 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -66.56 -56.36 11.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.857 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.862 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.7 p30 -65.97 -25.14 66.97 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -170.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -87.26 -35.0 18.74 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.624 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -71.45 -31.72 43.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 120.271 -0.572 . . . . 0.0 111.201 -177.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.4 pt -71.48 -4.67 4.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.935 0.397 . . . . 0.0 111.111 -179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -86.91 -19.46 28.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.645 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.13 -17.48 17.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.235 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.624 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.8 mt -82.83 144.19 30.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.287 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.94 133.34 40.5 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.982 177.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -76.43 53.26 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.786 -175.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.625 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -162.47 -31.38 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.201 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.625 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -87.17 158.97 19.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.22 0.534 . . . . 0.0 111.267 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.8 m -110.51 121.02 44.3 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.223 176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 84.0 m-85 -107.4 123.74 48.81 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.824 ' HA ' HG12 ' A' ' 103' ' ' VAL . 49.2 m-85 -57.89 137.99 56.17 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.753 HD21 ' HG ' ' A' ' 104' ' ' LEU . 85.1 mt -105.14 163.66 12.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.249 173.236 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.62 14.75 34.31 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.623 -175.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.533 ' HG ' ' CE2' ' A' ' 75' ' ' TRP . 1.1 mt -82.66 116.81 22.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.301 0.55 . . . . 0.0 110.195 178.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.623 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 11.1 ttm180 -113.26 126.26 55.21 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -177.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.452 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 12.6 t70 -123.89 145.82 48.85 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 156.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.532 ' HG3' ' HD2' ' A' ' 70' ' ' LYS . 4.8 pt-20 -120.63 6.24 10.54 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 113.581 0.956 . . . . 0.0 113.581 -162.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.453 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 0.2 OUTLIER 179.87 29.92 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.917 179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 59.7 38.26 21.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.538 0.685 . . . . 0.0 109.456 -174.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.532 ' HD2' ' HG3' ' A' ' 67' ' ' GLU . 96.8 mttt -81.92 -22.85 36.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.074 -173.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 86.23 19.66 56.69 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -175.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -100.39 63.59 1.12 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.198 -0.501 . . . . 0.0 110.253 -175.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.424 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.8 m95 -70.06 104.35 2.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.679 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 34.8 mtm180 -134.11 141.1 47.01 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.407 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.585 ' HB3' HG22 ' A' ' 40' ' ' THR . 79.9 m95 -88.55 125.27 34.7 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 76' ' ' VAL . 6.2 p -70.63 82.62 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-O 122.141 0.972 . . . . 0.0 110.326 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.74 ' HA ' ' CD2' ' A' ' 37' ' ' HIS . 2.1 t70 -172.88 -59.54 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.591 -174.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 52.8 tp60 163.34 -31.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.888 1.368 . . . . 0.0 107.615 -177.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.466 ' O ' ' HB2' ' A' ' 75' ' ' TRP . 26.3 m -59.98 120.18 48.14 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.255 -1.339 . . . . 0.0 111.925 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 9.5 Cg_exo -75.49 169.18 22.92 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 123.023 2.482 . . . . 0.0 111.287 173.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 61.3 t80 -64.84 125.38 24.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.707 0.289 . . . . 0.0 110.444 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 4.3 m-80 -80.06 110.49 16.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.893 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.4 -31.33 17.88 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.694 2.263 . . . . 0.0 112.307 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -89.7 -11.91 40.99 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.524 -178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 76.3 mtt180 -127.91 80.39 1.96 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.994 0.426 . . . . 0.0 111.283 -175.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.9 t -121.64 98.99 6.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -98.94 69.0 1.75 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 35.7 m95 -65.8 150.03 49.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.953 0.406 . . . . 0.0 111.007 178.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.506 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 8.7 t-80 -64.79 -51.21 63.43 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.4 pttm 175.79 -159.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -72.43 74.89 1.04 Allowed 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 168.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.468 ' HG2' ' OD1' ' A' ' 114' ' ' ASN . 4.4 tp10 -91.79 120.25 68.09 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.806 -170.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -72.06 -50.6 0.25 Allowed 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.745 2.296 . . . . 0.0 111.658 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.4 t70 55.17 -97.4 0.07 Allowed 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.933 177.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.417 ' H ' ' H ' ' A' ' 96' ' ' SER . 12.3 t-20 175.75 -8.73 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -175.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.473 ' HB2' ' O ' ' A' ' 115' ' ' ASP . 28.0 t -41.82 118.95 1.19 Allowed 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 114.836 -1.075 . . . . 0.0 112.502 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -164.73 149.42 9.47 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.808 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 76.9 -110.29 2.99 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.108 -1.044 . . . . 0.0 110.695 -175.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.672 ' HG2' ' H ' ' A' ' 118' ' ' CYS . 6.3 pm0 -88.74 138.3 31.54 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 174.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.452 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 5.1 p30 -133.23 122.8 24.47 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.587 0.708 . . . . 0.0 110.994 -175.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 73.1 m -130.04 127.26 39.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.123 -0.944 . . . . 0.0 109.465 -179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.585 ' HA ' ' HA ' ' A' ' 115' ' ' ASP . 30.4 m -81.63 145.67 8.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.238 0.542 . . . . 0.0 111.59 -175.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.824 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -128.2 155.46 39.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.009 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.753 ' HG ' HD21 ' A' ' 62' ' ' LEU . 25.9 mt -86.43 105.83 17.03 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 171.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -116.99 141.32 35.79 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.821 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 53.7 t80 -93.09 96.62 10.17 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.021 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.477 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 45.5 t-20 -138.83 140.46 38.51 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.38 27.24 16.89 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 5.5 m-20 62.14 17.06 8.84 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.127 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -121.6 133.37 54.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.383 0.611 . . . . 0.0 111.302 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -79.77 124.98 29.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.071 171.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.506 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -163.56 170.12 17.7 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.595 177.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -73.65 125.81 28.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.242 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.468 ' OD1' ' HG2' ' A' ' 92' ' ' GLU . 4.2 t30 -124.59 120.25 31.37 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.585 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 10.5 p-10 -89.79 124.85 35.01 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.465 0.65 . . . . 0.0 110.378 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.436 HG13 HD22 ' A' ' 114' ' ' ASN . 30.1 m -129.38 159.4 69.45 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.965 -178.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 96' ' ' SER . 5.5 Cg_endo -49.57 128.55 21.16 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.52 2.147 . . . . 0.0 110.781 172.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.672 ' H ' ' HG2' ' A' ' 99' ' ' GLU . 10.6 m -74.07 -4.09 33.42 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.901 0.382 . . . . 0.0 111.446 -173.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -90.44 0.5 57.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.552 174.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -82.99 140.97 32.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.158 -0.473 . . . . 0.0 109.87 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.411 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 8.8 mt-10 -93.05 132.2 37.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.105 0.479 . . . . 0.0 111.153 177.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -152.9 -171.4 3.92 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.343 177.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 36.2 m -81.2 170.31 16.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.493 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 14.2 ptt180 -149.08 159.85 43.86 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.201 0.524 . . . . 0.0 112.32 -171.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.958 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 39.9 mt -123.55 132.28 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.1 t -112.33 130.4 55.96 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -115.63 123.89 49.55 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.655 -176.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.461 HG22 ' HB2' ' A' ' 14' ' ' CYS . 13.8 tt -114.06 135.83 22.14 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 176.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.72 167.02 22.26 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.413 2.075 . . . . 0.0 111.015 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.9 54.1 2.15 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.058 177.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.7 t -88.06 2.22 52.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.831 0.348 . . . . 0.0 111.055 -175.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.413 ' HB ' HG13 ' A' ' 2' ' ' VAL . 7.3 m -61.9 -26.86 68.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.034 0.445 . . . . 0.0 110.487 177.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 81.2 mt -67.92 -30.07 69.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.301 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -87.5 -14.51 40.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.203 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.586 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -90.76 22.03 3.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.936 -175.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -64.41 -63.65 1.08 Allowed 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 121.166 -0.214 . . . . 0.0 111.426 -176.469 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.55 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 37.7 m-80 -85.18 -23.7 28.24 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.982 0.42 . . . . 0.0 110.138 175.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.586 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 2.3 tm? -58.96 -54.88 42.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.928 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.681 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 56.5 t80 -75.58 -20.35 58.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.058 0.456 . . . . 0.0 110.343 -179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -66.32 -28.33 68.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 0.0 109.851 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -86.95 -31.15 20.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.65 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . 0.681 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 99.0 p . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.29 -0.862 . . . . 0.0 111.462 -171.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.3 m -140.56 148.7 21.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 29.6 p -116.52 123.92 30.03 Favored Pre-proline 0 C--N 1.319 -0.748 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 175.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 12.6 Cg_exo -70.91 170.5 17.81 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.841 2.36 . . . . 0.0 111.401 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.563 ' H ' HD13 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -61.68 -10.34 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.917 0.389 . . . . 0.0 111.193 176.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -63.37 -35.63 81.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.191 172.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HD2' ' A' ' 4' ' ' PRO . 16.2 m95 -84.85 142.78 29.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.301 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -85.19 107.34 17.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.801 0.334 . . . . 0.0 110.171 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -76.39 135.48 39.48 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.86 178.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 78.5 t80 -133.8 110.09 9.54 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.547 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 67.64 -68.42 0.16 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.041 0.838 . . . . 0.0 110.932 -177.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 p -145.88 -28.24 0.43 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.94 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -86.37 170.95 11.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.912 0.386 . . . . 0.0 111.15 -174.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.543 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 8.3 m -123.23 132.7 54.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.773 -176.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.472 ' CE1' ' HB2' ' A' ' 127' ' ' LYS . 90.2 m-85 -129.03 129.89 45.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.732 0.301 . . . . 0.0 111.519 -174.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.422 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 59.6 t80 -129.5 117.79 18.79 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.891 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -88.58 136.33 3.21 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.293 2.662 . . . . 0.0 112.262 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.58 137.81 52.35 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 9.8 p -91.05 -4.17 56.58 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.104 0.478 . . . . 0.0 111.061 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.51 ' O ' ' HA ' ' A' ' 123' ' ' SER . 16.3 t70 -77.22 154.01 33.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.935 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.46 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 43.3 m-80 -108.5 140.2 42.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.712 0.291 . . . . 0.0 111.566 -170.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.848 ' HB2' ' HD3' ' A' ' 124' ' ' ARG . 48.8 mmtt -168.22 148.48 4.81 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.231 -177.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.532 HG23 ' OE2' ' A' ' 121' ' ' GLU . 73.2 p -64.47 173.34 2.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.481 177.115 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.402 ' HH2' ' HA ' ' A' ' 76' ' ' VAL . 13.2 t90 -60.24 -45.9 91.64 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -61.68 -48.9 78.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.722 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.736 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 4.7 mm-40 -60.59 -40.86 93.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.478 179.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.621 ' HA ' ' HD2' ' A' ' 124' ' ' ARG . 70.9 m -56.84 -45.58 82.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.307 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -76.91 -21.43 54.89 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.989 -176.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 34.7 mtm180 -73.08 -43.32 61.98 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.28 0.562 . . . . 0.0 110.149 173.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.49 -35.6 79.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.809 172.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 32' ' ' SER . 0.1 OUTLIER -85.56 -179.24 6.86 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.329 174.139 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 57.8 m 75.25 -43.91 0.52 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.784 0.434 . . . . 0.0 112.06 179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.95 -21.06 60.79 Favored Glycine 0 C--O 1.227 -0.3 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.032 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.7 ptp -100.16 8.25 43.98 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.017 0.437 . . . . 0.0 110.636 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.82 29.97 53.32 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.343 -178.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.86 -178.8 4.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.545 0.212 . . . . 0.0 110.918 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.525 ' HB3' HG11 ' A' ' 76' ' ' VAL . 4.7 m-70 -143.12 168.2 20.31 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.9 mp -57.42 157.45 6.66 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 111.62 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.633 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.6 tpt -52.92 99.4 0.02 OUTLIER 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.505 -176.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.507 ' H ' ' HG2' ' A' ' 127' ' ' LYS . 7.4 p -97.15 90.44 5.14 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.314 170.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.444 HD11 HD11 ' A' ' 104' ' ' LEU . 42.5 mt -55.65 106.08 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.862 -178.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.4 m -70.78 -51.47 26.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.596 -177.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.6 p -130.12 161.38 31.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.38 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.499 ' CD ' HH21 ' A' ' 84' ' ' ARG . 6.1 pt-20 -66.69 -27.94 68.05 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.986 0.422 . . . . 0.0 110.293 176.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.02 -36.78 84.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.164 174.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.56 -45.71 91.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.168 176.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.452 ' O ' HG23 ' A' ' 51' ' ' ILE . 55.1 tt0 -56.95 -53.88 52.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.05 175.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -58.87 -24.14 61.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.161 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -81.99 -52.08 7.41 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.5 tp -66.92 -30.54 49.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 120.768 0.318 . . . . 0.0 111.619 -172.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.704 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.3 pt -73.16 -1.41 2.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.996 0.426 . . . . 0.0 111.746 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -83.58 -26.25 30.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.942 175.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -99.13 -23.78 15.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.484 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 83.6 mt -63.95 135.6 56.64 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.126 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.504 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -71.47 124.51 24.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 177.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.603 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 81.8 mtt180 -79.05 20.21 0.5 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -168.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.873 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.7 ptp180 -116.18 -15.71 11.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.721 0.296 . . . . 0.0 110.356 174.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.873 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -97.41 172.64 7.63 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.387 0.613 . . . . 0.0 111.439 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.3 m -128.28 117.95 22.41 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.061 176.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.492 ' HB3' HG13 ' A' ' 125' ' ' ILE . 78.2 m-85 -101.59 127.54 48.26 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.315 -171.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.662 ' HA ' HG12 ' A' ' 103' ' ' VAL . 1.7 m-85 -62.04 145.01 54.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.154 0.502 . . . . 0.0 112.232 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.667 ' HB2' HG13 ' A' ' 102' ' ' VAL . 95.9 mt -112.61 168.61 9.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.679 175.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -74.44 3.8 38.56 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 115.18 0.832 . . . . 0.0 115.18 -172.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.913 ' HB2' HG12 ' A' ' 102' ' ' VAL . 4.0 mm? -73.46 117.34 15.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 118.244 1.022 . . . . 0.0 110.903 -178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -120.23 122.64 41.36 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.331 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' HB3' ' OD1' ' A' ' 100' ' ' ASN . 29.9 t70 -141.78 90.69 2.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.852 0.834 . . . . 0.0 109.911 163.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.679 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -74.45 -71.04 0.36 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.621 -177.767 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -84.67 31.61 0.53 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.459 -170.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 49.73 69.93 0.55 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.219 0.533 . . . . 0.0 111.559 178.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.8 mtmm -95.53 -12.79 25.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.12 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.45 -40.35 2.58 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.014 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -81.16 98.04 7.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.073 0.463 . . . . 0.0 110.751 177.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.596 ' HB3' HD12 ' A' ' 64' ' ' LEU . 58.6 m95 -59.82 128.04 34.93 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.993 175.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -121.09 129.75 53.45 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.23 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.756 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 55.6 m95 -81.61 108.14 14.94 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.388 178.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 37' ' ' HIS . 48.0 t 45.77 -80.72 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 O-C-N 124.706 1.254 . . . . 0.0 114.117 172.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 75' ' ' TRP . 4.3 t70 -96.33 -82.5 0.39 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.919 -168.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.44 -19.21 5.51 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.756 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 70.1 m -62.69 118.71 44.11 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-O 120.936 0.398 . . . . 0.0 111.928 -170.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.5 Cg_exo -71.09 169.8 19.7 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.616 2.877 . . . . 0.0 112.555 179.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -67.2 151.24 47.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.345 0.593 . . . . 0.0 110.976 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.644 ' ND2' ' HB2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -119.4 127.08 26.65 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.125 -174.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.4 Cg_exo -67.79 -30.3 34.04 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.859 2.373 . . . . 0.0 112.48 175.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.499 HH21 ' CD ' ' A' ' 44' ' ' GLU . 11.2 tpt180 -78.12 -49.81 13.19 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 120.564 0.221 . . . . 0.0 111.484 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.644 ' HB2' ' ND2' ' A' ' 82' ' ' ASN . 29.9 mtm180 -80.49 81.25 6.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.069 0.461 . . . . 0.0 110.431 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.501 HG13 ' CD1' ' A' ' 88' ' ' TRP . 95.9 t -138.26 103.75 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.558 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.46 ' HB2' ' CD1' ' A' ' 113' ' ' TRP . 50.7 m-85 -125.93 39.66 3.9 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -171.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.629 ' HB2' ' HE3' ' A' ' 90' ' ' LYS . 66.2 m95 -65.77 160.46 22.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.611 0.243 . . . . 0.0 111.461 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 77.3 m-70 -77.5 -27.77 51.95 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.126 -176.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.629 ' HE3' ' HB2' ' A' ' 88' ' ' TRP . 6.8 mmtp 81.79 -5.59 1.51 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 124.431 1.082 . . . . 0.0 110.14 -176.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.611 ' OD1' ' HB3' ' A' ' 89' ' ' HIS . 2.8 p-10 -113.97 25.77 10.88 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.723 174.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.515 ' OE2' ' HB2' ' A' ' 89' ' ' HIS . 1.6 mp0 -57.24 145.82 64.84 Favored Pre-proline 0 C--O 1.233 0.223 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.035 176.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -80.05 -163.14 0.21 Allowed 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.658 2.239 . . . . 0.0 112.093 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.08 114.85 2.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.662 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.515 ' HA ' ' OD2' ' A' ' 115' ' ' ASP . 12.5 m120 -65.9 130.0 41.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.85 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.0 t -78.79 126.16 30.34 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.123 -175.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -0.27 54.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.253 0.549 . . . . 0.0 110.473 175.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -131.37 105.09 0.61 Allowed Glycine 0 N--CA 1.445 -0.721 0 N-CA-C 110.559 -1.016 . . . . 0.0 110.559 175.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 42.3 mt-10 63.2 88.58 0.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.905 0.383 . . . . 0.0 111.28 -174.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.552 ' OD1' ' HB3' ' A' ' 66' ' ' ASP . 6.9 p30 -107.62 118.93 38.02 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.346 0.593 . . . . 0.0 109.45 173.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 63.9 m -135.93 144.34 45.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.867 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.913 HG12 ' HB2' ' A' ' 64' ' ' LEU . 12.1 p -100.43 146.74 8.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 120.987 0.422 . . . . 0.0 111.432 -175.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 61' ' ' PHE . 22.6 m -129.85 156.48 42.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.763 175.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.57 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.8 mt -88.52 113.4 24.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 171.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.5 p -125.8 141.33 45.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.397 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.511 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 61.3 t80 -79.92 103.84 10.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.151 -179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 26.1 t-20 -149.19 135.47 19.21 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.451 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 91.4 mt-30 66.38 31.9 7.97 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -172.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.418 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 12.5 m-20 59.53 26.25 15.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.732 177.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -145.56 153.1 40.72 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.196 174.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.704 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 88.0 m95 -87.53 107.05 18.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.853 176.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -129.32 167.31 17.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.944 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.531 ' HB3' HG21 ' A' ' 102' ' ' VAL . 25.2 m0 -74.74 129.16 37.21 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.076 -0.965 . . . . 0.0 111.268 -174.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -127.18 139.63 52.81 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 176.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.515 ' OD2' ' HA ' ' A' ' 95' ' ' ASN . 19.1 t70 -89.19 125.24 34.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.737 0.303 . . . . 0.0 111.178 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.1 m -143.41 158.05 58.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.513 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 13.4 Cg_endo -58.28 138.11 84.12 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.517 2.145 . . . . 0.0 111.771 174.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.6 m -70.49 -18.76 62.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.714 0.292 . . . . 0.0 111.029 -178.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -86.1 16.07 4.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.294 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -100.07 126.63 46.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.532 ' OE2' HG23 ' A' ' 23' ' ' THR . 3.2 mm-40 -73.49 124.18 25.33 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 177.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.404 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -144.16 176.64 9.17 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.475 177.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 35.0 m -67.55 157.62 33.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.894 0.378 . . . . 0.0 110.7 -177.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.848 ' HD3' ' HB2' ' A' ' 22' ' ' LYS . 80.6 mtm-85 -124.18 153.15 41.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.999 0.428 . . . . 0.0 111.984 -169.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.633 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 58.9 mt -134.92 120.72 31.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 171.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 12.5 m -103.49 131.75 50.34 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.507 ' HG2' ' H ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -123.33 135.55 54.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.221 0.534 . . . . 0.0 110.006 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.543 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -128.62 140.17 37.68 Favored Pre-proline 0 C--N 1.318 -0.781 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.562 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.77 166.88 3.37 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.617 2.212 . . . . 0.0 111.981 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -71.57 59.19 1.24 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.008 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 77.4 p -71.6 -22.44 61.71 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.069 0.461 . . . . 0.0 110.349 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.8 m -71.93 -14.57 61.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.061 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.6 mp -80.06 -32.35 39.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.54 -31.24 20.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 176.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.27 41.6 1.07 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.52 175.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.17 -44.6 79.31 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.028 -173.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -72.61 -27.21 62.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.797 0.332 . . . . 0.0 110.316 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.05 -48.3 74.28 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -71.53 -23.26 61.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.282 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -67.97 -33.09 73.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 0.0 110.243 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -87.93 -6.47 58.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.435 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.387 -0.816 . . . . 0.0 111.103 -175.829 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.499 HG12 ' CG2' ' A' ' 132' ' ' THR . 9.8 p -140.7 142.0 31.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.801 0.334 . . . . 0.0 110.307 177.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.0 m -139.2 162.37 52.38 Favored Pre-proline 0 C--N 1.32 -0.694 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -52.82 142.07 52.99 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.063 1.842 . . . . 0.0 111.131 174.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.3 mt -73.79 80.47 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -173.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 176.68 -51.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.214 -1.357 . . . . 0.0 108.206 175.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 17.9 m95 -42.23 123.74 2.57 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.295 177.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 mmt-85 -71.74 107.21 4.44 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -171.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 128.31 33.28 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.235 -176.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 83.8 t80 -139.25 102.11 4.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.644 179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 60.67 -89.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.139 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 m -120.27 7.56 10.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.682 0.277 . . . . 0.0 111.282 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -130.35 158.51 39.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.856 0.36 . . . . 0.0 110.99 -176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB2' HG22 ' A' ' 128' ' ' ILE . 74.9 m -131.97 127.52 36.49 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 79.2 m-85 -115.41 129.06 56.45 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -170.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 33.1 t80 -121.34 114.87 31.6 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 174.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 6.5 Cg_endo -88.48 123.36 1.54 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.326 2.684 . . . . 0.0 112.288 177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.461 HD22 ' CZ ' ' A' ' 124' ' ' ARG . 4.7 mp -109.82 139.39 44.95 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 p -105.31 14.98 28.07 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.373 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -85.83 162.29 18.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.0 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 20.0 m120 -85.12 118.24 24.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 1.025 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -149.03 141.73 24.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.772 178.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 62.8 p -72.63 174.55 7.39 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 174.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.446 ' CH2' HG23 ' A' ' 76' ' ' VAL . 31.2 t90 -62.42 -39.75 94.29 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 177.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.01 -46.3 68.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.764 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 1.025 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 15.8 mm-40 -61.14 -37.32 82.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.456 179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.431 ' HB2' HD21 ' A' ' 38' ' ' LEU . 68.8 m -60.05 -49.29 78.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.715 178.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.621 ' HG2' HD13 ' A' ' 38' ' ' LEU . 19.6 mm-40 -69.69 -22.02 63.45 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.407 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -67.93 -39.81 83.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.79 0.329 . . . . 0.0 110.918 177.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.28 -25.98 36.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.333 0.587 . . . . 0.0 109.567 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 88.4 m -85.65 -180.0 6.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.522 172.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.407 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 51.7 m 73.34 -44.92 0.6 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.928 0.491 . . . . 0.0 111.66 -178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.63 -22.99 66.59 Favored Glycine 0 C--O 1.227 -0.336 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.758 174.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.5 mtm -96.93 9.53 41.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.33 . . . . 0.0 110.696 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 72.64 27.75 68.68 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.878 -0.677 . . . . 0.0 111.998 -177.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -129.85 173.83 10.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.475 0.178 . . . . 0.0 111.028 -175.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -140.2 168.66 19.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 175.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.621 HD13 ' HG2' ' A' ' 28' ' ' GLU . 10.8 mp -61.44 149.42 38.63 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.209 0.318 . . . . 0.0 110.37 173.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.4 tpt -50.71 103.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -175.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.515 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 11.8 p -94.45 94.85 8.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.077 172.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.483 HD11 HD11 ' A' ' 104' ' ' LEU . 55.9 mt -66.99 95.8 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.237 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.9 m -92.75 -27.79 17.0 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.299 0.571 . . . . 0.0 109.811 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 53.0 p -125.2 147.87 48.87 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 122.238 1.018 . . . . 0.0 112.163 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.43 ' OE2' ' HD3' ' A' ' 85' ' ' ARG . 19.9 mt-10 -59.9 -31.45 69.83 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.629 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.446 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.4 -46.04 88.23 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.582 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.464 ' HB3' ' CE ' ' A' ' 39' ' ' MET . 24.7 mt-10 -49.23 -55.29 13.05 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.583 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -55.36 -52.69 62.68 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.001 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -59.25 -34.77 72.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.446 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 59.9 m-85 -88.31 -37.7 15.76 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -177.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.611 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.6 tp -70.21 -30.75 44.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.283 -174.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.492 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 37.4 pt -71.29 -6.08 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.309 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -87.44 -21.54 25.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.025 176.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -94.81 -23.91 17.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.636 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.6 mt -74.28 139.84 44.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.543 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.421 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.0 t70 -75.36 133.81 41.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 175.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 81.5 mtt180 -80.22 16.71 1.19 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -169.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.939 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.9 ptp180 -119.59 -12.31 9.31 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.936 -0.305 . . . . 0.0 110.719 176.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.939 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -103.11 148.3 25.91 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.174 0.511 . . . . 0.0 111.607 -179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.9 p -100.5 116.91 33.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.541 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB3' HG13 ' A' ' 125' ' ' ILE . 95.4 m-85 -100.77 121.69 42.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.48 -174.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.838 ' HA ' HG12 ' A' ' 103' ' ' VAL . 14.1 m-85 -58.41 137.42 57.29 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.765 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.598 HD21 ' HG ' ' A' ' 104' ' ' LEU . 96.4 mt -105.61 157.11 17.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.942 176.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.463 ' O ' ' HE3' ' A' ' 75' ' ' TRP . . . -79.06 61.83 4.07 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.442 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.606 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 21.3 tp -129.64 134.22 47.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -135.33 134.91 40.33 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -170.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -133.61 88.96 2.53 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 164.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -81.84 134.05 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.89 0.376 . . . . 0.0 111.519 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 70.07 18.41 7.09 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.47 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.498 ' HB2' ' H ' ' A' ' 98' ' ' GLY . . . 62.23 87.55 0.1 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 121.314 0.578 . . . . 0.0 111.662 177.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.467 ' HE3' ' HB2' ' A' ' 70' ' ' LYS . 21.2 mtmt -112.38 -47.72 3.07 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.414 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 102.8 -19.3 47.59 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -94.9 83.85 4.06 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 121.227 0.537 . . . . 0.0 110.033 176.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.606 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 60.5 m95 -66.23 137.28 56.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.501 -178.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.419 ' O ' HD12 ' A' ' 64' ' ' LEU . 63.7 mtt180 -125.65 166.11 17.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 175.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.545 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 96.7 m95 -81.56 176.56 9.56 Favored 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 119.719 -0.793 . . . . 0.0 109.307 171.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.446 HG23 ' CH2' ' A' ' 24' ' ' TRP . 13.7 p -63.07 -34.4 66.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.854 0.359 . . . . 0.0 111.38 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -107.24 -168.78 1.44 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 177.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -77.6 73.72 4.17 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.42 0.629 . . . . 0.0 110.161 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.545 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 8.1 m -131.15 129.22 22.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.222 177.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 19.3 Cg_exo -68.66 144.91 61.83 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.237 2.625 . . . . 0.0 112.271 176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.408 ' HZ ' HG23 ' A' ' 86' ' ' VAL . 68.3 t80 -69.43 143.43 53.6 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.17 -176.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.565 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 25.3 m-80 -77.55 110.39 12.55 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.704 177.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -67.94 -50.37 0.84 Allowed 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.984 2.456 . . . . 0.0 112.776 -177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -82.71 -0.88 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.748 0.309 . . . . 0.0 111.507 -177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.565 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 29.8 mtm180 -129.55 62.85 1.53 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.408 HG23 ' HZ ' ' A' ' 81' ' ' PHE . 13.0 p -85.31 -32.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.261 178.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 66.7 -70.01 0.11 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 174.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.419 ' HB3' ' H ' ' A' ' 89' ' ' HIS . 76.8 m95 53.49 -158.49 0.16 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.746 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.565 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 10.4 t-80 -99.69 -23.8 14.91 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.886 0.374 . . . . 0.0 110.952 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.586 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 21.4 ttpp 171.11 -70.9 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.4 p30 -140.38 11.75 2.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.086 -0.961 . . . . 0.0 108.652 166.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.586 ' OE1' ' HB3' ' A' ' 90' ' ' LYS . 1.7 mp0 -79.36 104.85 2.55 Favored Pre-proline 0 N--CA 1.453 -0.325 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.155 175.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 88.1 Cg_endo -101.22 -151.9 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.031 0 C-N-CA 123.72 2.947 . . . . 0.0 113.347 -172.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -60.8 136.29 58.03 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.315 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -134.67 -37.91 0.82 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.946 0.403 . . . . 0.0 110.965 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.409 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 23.3 t -85.36 152.14 23.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.138 -178.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -126.79 134.13 50.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.815 0.34 . . . . 0.0 110.24 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.498 ' H ' ' HB2' ' A' ' 69' ' ' ALA . . . 91.22 -63.27 2.77 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.531 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 40.8 mt-10 -113.29 74.69 0.88 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.804 0.335 . . . . 0.0 110.114 172.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.409 ' HB3' ' O ' ' A' ' 96' ' ' SER . 1.7 p-10 -106.32 125.19 50.7 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.414 0.626 . . . . 0.0 110.29 177.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 2.2 p -157.66 136.57 11.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.964 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 30.1 m -88.67 147.7 5.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.408 0.623 . . . . 0.0 112.155 -173.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.838 HG12 ' HA ' ' A' ' 61' ' ' PHE . 25.2 m -124.5 158.62 31.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.14 174.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.598 ' HG ' HD21 ' A' ' 62' ' ' LEU . 31.7 mt -84.0 115.64 22.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 171.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.5 p -125.87 141.49 45.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.759 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.688 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 63.4 t80 -91.19 97.5 11.17 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.377 -0.828 . . . . 0.0 109.4 176.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.413 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 47.7 t-20 -141.38 132.93 26.97 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 66.18 31.85 8.42 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 123.838 0.712 . . . . 0.0 109.32 -171.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 15.2 m-20 60.09 25.06 14.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 114.55 -1.205 . . . . 0.0 112.414 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.542 ' HZ2' ' HB2' ' A' ' 90' ' ' LYS . 59.3 pttt -132.97 141.58 48.39 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.211 0.529 . . . . 0.0 111.018 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.492 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 83.2 m95 -88.37 110.77 21.06 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.762 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.565 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -148.47 170.84 17.14 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.407 -0.517 . . . . 0.0 111.089 -178.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 26.7 m0 -73.91 134.29 43.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.757 -175.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -134.01 123.93 25.4 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -77.08 131.68 38.5 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.866 0.365 . . . . 0.0 110.9 -178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 19.4 m -140.75 158.89 64.46 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.337 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.526 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 16.2 Cg_endo -59.22 128.69 28.45 Favored 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.302 2.001 . . . . 0.0 111.138 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.556 ' O ' ' HB ' ' A' ' 23' ' ' THR . 83.6 m -65.84 -17.34 64.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -177.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -82.49 -2.29 52.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.771 0.319 . . . . 0.0 111.263 177.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -83.7 115.45 22.19 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.519 ' OE2' ' HA ' ' A' ' 22' ' ' LYS . 1.4 mt-10 -72.34 110.64 6.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.452 0.644 . . . . 0.0 110.671 178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -130.44 -172.05 2.7 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.511 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 33.1 m -78.25 169.57 18.05 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.461 ' CZ ' HD22 ' A' ' 18' ' ' LEU . 11.9 ptt180 -151.04 150.24 30.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.098 0.475 . . . . 0.0 111.91 -171.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.642 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.1 mt -115.24 121.37 67.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 174.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.94 121.46 44.82 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.515 ' HD3' ' H ' ' A' ' 40' ' ' THR . 22.3 ptmt -115.41 127.36 55.31 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.985 0.422 . . . . 0.0 111.048 -176.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.549 HG22 ' HB2' ' A' ' 14' ' ' CYS . 14.6 tt -103.98 134.18 19.85 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.24 167.47 25.79 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.076 1.85 . . . . 0.0 110.938 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -68.26 60.86 0.41 Allowed Glycine 0 CA--C 1.521 0.442 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.131 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -76.63 10.37 2.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.198 0.523 . . . . 0.0 111.304 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.499 ' CG2' HG12 ' A' ' 2' ' ' VAL . 1.9 m -67.28 -18.58 65.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.583 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mp -73.03 -34.48 66.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.182 177.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -77.42 -38.3 49.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 0.0 109.337 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -85.46 31.22 0.59 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.981 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 12.3 pt-20 -60.12 -35.21 74.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.715 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.411 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 76.8 m-20 -73.31 -28.64 62.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.548 -177.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.7 tt -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 175.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -68.17 -20.34 64.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.46 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -71.71 -38.58 70.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -73.91 -40.27 63.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.241 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 44.4 m . . . . . 0 C--O 1.249 1.047 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.57 -179.269 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.0 ptt? . . . . . 0 N--CA 1.483 1.218 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.696 HG13 HG21 ' A' ' 132' ' ' THR . 2.4 p -69.45 120.05 16.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.54 0.686 . . . . 0.0 110.877 -179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.641 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 71.3 m -144.72 -178.36 0.78 Allowed Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 114.726 -1.125 . . . . 0.0 108.07 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.641 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 95.1 Cg_exo -46.98 147.68 4.74 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 121.818 1.679 . . . . 0.0 111.851 170.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tp -59.38 146.86 8.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.945 -172.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 77.81 -33.79 0.18 Allowed 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.51 1.124 . . . . 0.0 112.023 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 24.1 m95 -47.73 118.6 2.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.817 0.341 . . . . 0.0 110.124 175.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.3 mmt-85 -71.47 113.45 8.51 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.481 -172.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.52 124.13 31.74 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.774 -176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.457 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 33.0 t80 -121.44 104.33 9.6 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 58.89 -101.53 0.13 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.435 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 t -96.91 -36.16 10.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.346 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -80.42 169.12 18.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.562 -173.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 73.0 m -143.96 136.33 26.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.366 -179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 24.9 m-85 -121.71 131.86 54.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.251 -169.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -111.67 115.26 51.55 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.198 176.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -89.09 124.85 1.5 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 123.107 2.538 . . . . 0.0 111.574 174.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -138.01 143.9 40.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.402 0.62 . . . . 0.0 111.272 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 73.9 p -110.27 18.77 19.56 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.798 -170.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -78.58 130.51 36.02 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.423 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.621 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 4.8 m-20 -63.48 100.52 0.26 Allowed 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.921 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.621 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 14.8 mmmm -133.63 143.75 48.8 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 175.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.626 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.4 p -65.79 163.85 15.9 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 174.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 60.0 t90 -57.76 -39.35 77.2 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.12 -51.67 68.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.892 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.583 ' HA ' ' HB2' ' A' ' 29' ' ' ARG . 14.5 mm-40 -70.57 -26.92 63.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.239 -177.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 53.1 m -58.0 -50.39 73.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.763 0.316 . . . . 0.0 110.33 173.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -70.81 -25.89 63.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.658 178.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.583 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -71.1 -51.43 25.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.938 -178.575 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.431 ' HB3' HH12 ' A' ' 124' ' ' ARG . 3.7 t-20 -74.94 -30.67 61.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.1 0.476 . . . . 0.0 110.579 -177.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.5 m -84.51 179.42 7.41 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.2 m 80.04 -45.11 0.29 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.532 0.733 . . . . 0.0 109.966 -174.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.67 -25.7 70.53 Favored Glycine 0 CA--C 1.519 0.328 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.669 171.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.652 ' HG3' ' H ' ' A' ' 36' ' ' ALA . 21.7 ptp -88.7 1.79 54.49 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.864 0.364 . . . . 0.0 110.573 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.44 -13.11 59.02 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.217 -176.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.652 ' H ' ' HG3' ' A' ' 34' ' ' MET . . . -95.43 141.13 29.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.89 -0.182 . . . . 0.0 110.512 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.543 ' CD2' HG13 ' A' ' 76' ' ' VAL . 13.5 t60 -118.97 158.14 26.34 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.446 ' HB2' HG21 ' A' ' 76' ' ' VAL . 5.9 mp -51.71 139.03 22.09 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -174.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.655 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.0 tpt -40.02 98.68 0.01 OUTLIER 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.436 -1.256 . . . . 0.0 113.448 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.56 ' H ' ' HD3' ' A' ' 127' ' ' LYS . 6.4 p -94.79 91.84 6.67 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.453 169.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 59.9 mt -59.4 100.72 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.279 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 9.8 m -85.64 -34.4 21.37 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.032 -175.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.568 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 35.1 p -130.23 151.61 50.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.379 0.609 . . . . 0.0 111.374 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -65.86 -35.51 80.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.851 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.3 -41.51 98.57 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 120.914 0.387 . . . . 0.0 110.357 175.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.568 ' HB3' ' O ' ' A' ' 43' ' ' THR . 66.4 tt0 -52.34 -51.76 57.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.611 175.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.83 -46.05 90.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.66 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -62.39 -28.36 69.73 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.116 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.555 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 15.9 m-85 -85.32 -31.87 22.79 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.8 tp -78.36 -32.69 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.029 -0.668 . . . . 0.0 111.384 -176.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.2 pt -65.28 -20.47 27.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.5 pt20 -87.79 -11.36 48.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.097 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -92.48 -26.34 18.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.049 0.452 . . . . 0.0 110.03 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 68.0 mt -77.05 159.94 29.48 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.982 -176.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.404 ' OD2' HD13 ' A' ' 58' ' ' LEU . 4.2 t70 -70.61 137.75 50.23 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.826 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -90.23 38.82 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.168 0.509 . . . . 0.0 111.698 -171.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -142.15 -46.83 0.35 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.53 172.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.404 HD13 ' OD2' ' A' ' 55' ' ' ASP . 0.2 OUTLIER -61.67 163.49 7.15 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.797 0.808 . . . . 0.0 112.737 -171.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.875 ' HB3' HG11 ' A' ' 103' ' ' VAL . 1.4 m -108.17 129.9 55.16 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.94 175.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.516 ' N ' HG22 ' A' ' 103' ' ' VAL . 97.4 m-85 -117.38 120.15 37.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.517 0.198 . . . . 0.0 111.425 -175.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -66.94 130.15 42.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.084 0.468 . . . . 0.0 111.175 178.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.741 HD11 ' HB2' ' A' ' 104' ' ' LEU . 80.1 mt -111.63 175.93 5.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.337 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -82.73 39.44 2.71 Favored Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.69 -175.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.717 ' HB2' HG22 ' A' ' 102' ' ' VAL . 3.5 mm? -100.18 114.32 27.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 65' ' ' ARG . 7.9 ttt85 -120.41 114.8 22.35 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -168.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -127.97 105.68 8.58 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 166.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 23.4 mp0 -46.81 -78.24 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.902 -1.045 . . . . 0.0 113.265 -175.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -127.8 48.06 2.31 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.269 -170.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.35 70.87 0.59 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.595 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.4 mtmm -87.57 -15.53 37.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.818 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.83 -45.41 3.47 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -175.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.21 92.13 6.85 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.692 0.758 . . . . 0.0 110.086 174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 28.7 m95 -69.69 160.83 30.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.136 -0.938 . . . . 0.0 111.375 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 16.5 ptt180 -154.1 171.8 18.54 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.298 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -84.06 -176.18 6.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.976 0.417 . . . . 0.0 110.197 174.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.543 HG13 ' CD2' ' A' ' 37' ' ' HIS . 13.3 p -82.29 1.29 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.215 0.531 . . . . 0.0 111.486 -171.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.506 ' OD2' HG21 ' A' ' 40' ' ' THR . 1.6 p30 -123.89 -104.74 0.36 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.089 176.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -121.16 -23.59 5.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.466 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 22.1 m -54.46 123.02 41.6 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.634 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 27.3 Cg_exo -65.18 149.06 89.26 Favored 'Trans proline' 0 C--O 1.233 0.267 0 C-N-CA 123.135 2.556 . . . . 0.0 111.988 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.82 136.92 57.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.838 -178.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -87.81 112.15 47.01 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.88 7.4 4.63 Favored 'Trans proline' 0 CA--C 1.53 0.296 0 C-N-CA 122.646 2.231 . . . . 0.0 113.705 -174.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -119.27 -27.12 5.71 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.418 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -106.83 34.46 3.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.408 ' O ' HG13 ' A' ' 86' ' ' VAL . 6.2 p -80.42 95.76 2.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.846 0.832 . . . . 0.0 109.811 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -81.71 72.82 8.77 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.381 -174.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 11.1 m95 -69.78 152.39 44.66 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 174.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.571 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 11.6 t-80 -66.07 -42.53 89.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.901 -171.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -177.82 -59.8 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.33 0.586 . . . . 0.0 109.98 175.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.54 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 1.0 OUTLIER -135.08 0.1 2.82 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.808 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -95.05 105.48 19.64 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.474 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.54 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 86.6 Cg_endo -95.82 -154.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 123.369 2.713 . . . . 0.0 111.512 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.96 146.36 33.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 175.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.56 -34.66 0.24 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.855 -171.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.584 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 67.2 m -65.27 97.89 0.3 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 111.583 -176.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -74.16 83.65 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.82 175.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.04 97.87 1.01 Allowed Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 -174.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.606 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 33.1 mt-10 59.9 74.81 0.43 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.128 0.49 . . . . 0.0 110.858 -171.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.584 ' HB3' ' O ' ' A' ' 96' ' ' SER . 6.0 p-10 -100.58 101.75 12.74 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.573 0.701 . . . . 0.0 110.556 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 67.5 m -117.66 156.27 28.48 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.831 178.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.722 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 23.0 m -103.25 155.79 5.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.255 0.55 . . . . 0.0 110.819 177.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.875 HG11 ' HB3' ' A' ' 59' ' ' SER . 0.4 OUTLIER -123.03 143.98 34.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.533 176.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.741 ' HB2' HD11 ' A' ' 62' ' ' LEU . 17.8 tp -85.49 103.54 14.46 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 171.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.482 HG11 ' OD1' ' A' ' 114' ' ' ASN . 10.0 p -128.33 139.2 52.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.176 0.512 . . . . 0.0 111.785 -172.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.569 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 11.6 t80 -88.37 104.49 16.82 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -146.71 142.02 27.39 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 39.6 mt-30 53.46 65.69 1.45 Allowed 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.638 0.586 . . . . 0.0 110.342 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.1 p30 58.76 4.35 0.38 Allowed 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 173.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.589 ' HG2' ' O ' ' A' ' 108' ' ' GLN . 9.4 pttm -155.56 153.56 30.35 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.569 ' NE1' ' HD2' ' A' ' 106' ' ' TYR . 81.0 m95 -84.07 140.54 31.76 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 114.341 -1.299 . . . . 0.0 110.019 173.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.571 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -179.27 -179.4 0.55 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.65 0.594 . . . . 0.0 109.907 173.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.722 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 39.4 m0 -88.48 139.33 30.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.728 0.299 . . . . 0.0 111.03 -177.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.642 HD22 ' C ' ' A' ' 114' ' ' ASN . 0.1 OUTLIER -123.41 162.19 23.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.04 171.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.35 124.69 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 123.254 0.346 . . . . 0.0 110.928 178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -147.77 141.89 16.1 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.204 175.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.606 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 10.0 Cg_endo -55.86 136.02 72.49 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.476 2.117 . . . . 0.0 111.395 175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.439 ' HB2' ' OE1' ' A' ' 99' ' ' GLU . 15.0 m -67.15 -17.43 64.85 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.883 0.373 . . . . 0.0 110.665 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.32 7.27 33.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.113 0.482 . . . . 0.0 110.557 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' O ' ' HA ' ' A' ' 23' ' ' THR . 71.8 t80 -88.98 143.76 26.63 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.75 135.7 35.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.873 0.368 . . . . 0.0 110.947 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.3 -168.8 1.96 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.543 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.403 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 20.2 m -78.59 169.44 18.24 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 178.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.475 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 13.0 ptt180 -147.25 162.91 37.95 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 -172.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.655 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 8.3 mm -126.19 123.63 64.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.249 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 93.0 m -123.21 127.65 48.91 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.996 0.427 . . . . 0.0 110.293 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.56 ' HD3' ' H ' ' A' ' 40' ' ' THR . 21.6 ptmt -116.29 140.14 49.64 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.871 -175.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.405 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 16.0 tt -125.96 145.29 51.49 Favored Pre-proline 0 C--N 1.319 -0.724 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.211 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -64.06 167.33 14.43 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.514 2.143 . . . . 0.0 111.444 168.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.32 74.46 0.54 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.757 175.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 25.8 p -83.19 19.51 1.45 Allowed 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.506 0.323 . . . . 0.0 111.864 -175.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.696 HG21 HG13 ' A' ' 2' ' ' VAL . 14.5 t -60.15 -24.94 65.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.451 -178.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.6 mt -82.1 -23.83 35.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.986 0.422 . . . . 0.0 110.687 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -89.47 -49.51 6.65 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.341 177.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.52 33.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.67 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.641 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -59.76 -64.21 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -175.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.641 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 6.2 p30 -84.3 -20.29 32.36 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -58.66 -45.52 89.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.566 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -72.69 -21.56 61.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.38 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -73.31 -23.42 60.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.357 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 73.5 mt-30 -86.07 -6.8 58.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.066 177.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.01 -177.206 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.812 ' HG3' ' HA3' ' A' ' 130' ' ' GLY . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.4 p -164.53 131.91 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.923 0.392 . . . . 0.0 110.076 178.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.1 m -141.09 166.56 21.7 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -177.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 66.8 Cg_exo -51.9 154.67 9.56 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.567 2.178 . . . . 0.0 112.489 176.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.8 tp -70.2 -14.88 18.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.817 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.59 -31.74 68.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.987 176.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 24.1 m95 -86.5 160.67 18.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.704 -176.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 48.3 mmt-85 -111.8 122.89 49.02 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.112 177.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -98.37 124.29 42.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.121 -178.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.468 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 82.9 t80 -121.8 103.27 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.837 177.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 65.6 -73.26 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.1 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.585 ' HA ' ' HG2' ' A' ' 1' ' ' MET . 18.3 m -139.32 5.38 2.27 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -175.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -123.95 157.88 33.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.788 0.327 . . . . 0.0 111.003 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.8 m -122.87 128.0 49.76 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.681 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 3.7 m-85 -119.35 138.15 53.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.18 -174.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.425 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 62.1 t80 -139.23 115.68 8.51 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -88.01 138.11 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.839 2.36 . . . . 0.0 112.293 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.8 mp -124.43 139.6 53.74 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.974 0.416 . . . . 0.0 110.143 179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.5 p -110.31 35.19 3.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.871 177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -79.86 -27.23 40.11 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.3 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.519 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 46.6 m-80 70.08 116.19 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.62 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 13.3 mmmm -159.37 150.44 19.83 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.672 HG23 ' OE2' ' A' ' 121' ' ' GLU . 16.6 p -60.38 166.8 2.83 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 170.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.463 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 63.3 t90 -59.32 -42.26 90.98 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.511 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.41 -51.34 69.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.74 176.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.636 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 32.4 mm-40 -68.14 -31.22 70.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.129 -177.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.467 ' HB3' HD21 ' A' ' 38' ' ' LEU . 54.2 m -65.27 -40.74 94.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.822 0.344 . . . . 0.0 110.236 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -71.31 -34.02 70.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.761 179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.511 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 98.0 mtt180 -69.68 -40.15 76.54 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.845 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -76.16 -25.82 55.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.39 0.614 . . . . 0.0 109.769 179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 32' ' ' SER . 67.0 m -85.68 -179.45 6.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 167.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 29.1 m 79.46 -43.68 0.3 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.064 0.546 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.88 -25.18 67.48 Favored Glycine 0 C--O 1.227 -0.312 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.807 173.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 71.5 mtm -94.61 7.1 46.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.871 0.367 . . . . 0.0 110.392 177.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.6 -6.68 64.26 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.152 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.56 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.39 162.83 13.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.522 0.201 . . . . 0.0 110.69 -177.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -133.4 168.57 18.37 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 27' ' ' SER . 76.1 mt -61.39 146.28 48.8 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.931 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.528 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 12.6 tpt -44.88 110.79 0.25 Allowed 'General case' 0 N--CA 1.466 0.347 0 O-C-N 124.161 0.913 . . . . 0.0 113.178 -172.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB3' ' A' ' 75' ' ' TRP . 23.7 p -101.8 105.76 16.66 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.892 173.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.545 HD11 HD11 ' A' ' 104' ' ' LEU . 45.4 mt -79.2 119.42 28.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.091 0.472 . . . . 0.0 110.538 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.5 p -106.58 -36.62 6.7 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.261 -177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 70.5 p -127.71 152.97 47.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 121.576 0.703 . . . . 0.0 112.032 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -62.93 -33.05 74.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.53 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.429 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -68.29 -44.45 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.622 177.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -52.54 -48.71 65.94 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.885 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -59.96 -48.94 79.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.978 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -62.19 -23.09 66.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.238 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.429 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 30.5 m-85 -88.33 -39.07 14.64 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 177.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.552 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -71.4 -30.49 39.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.305 -176.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.1 pt -71.62 -3.96 4.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.85 0.357 . . . . 0.0 111.312 -179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -87.25 -21.74 25.63 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.852 175.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 -19.77 18.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.151 178.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 79.1 mt -79.06 134.05 36.77 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.966 179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -71.25 128.29 35.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.112 -0.494 . . . . 0.0 109.964 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 25.1 mtt180 -72.39 53.78 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -160.33 -29.95 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.317 177.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.702 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -86.9 158.39 19.32 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.29 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.7 m -109.47 118.89 37.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.527 176.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.754 ' HB3' HG13 ' A' ' 125' ' ' ILE . 91.4 m-85 -105.23 120.91 42.71 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 111.757 0.281 . . . . 0.0 111.757 -173.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.748 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.8 m-85 -58.6 137.87 57.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.104 0.478 . . . . 0.0 112.048 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.668 HD21 ' HG ' ' A' ' 104' ' ' LEU . 91.1 mt -103.8 166.02 10.68 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.707 175.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -87.07 34.74 3.53 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.898 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.6 tp -92.11 114.74 27.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.514 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 21.7 ttm-85 -104.19 126.99 51.76 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -168.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.481 ' O ' ' HA ' ' A' ' 99' ' ' GLU . 16.2 t70 -142.24 101.05 3.84 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.896 168.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.514 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 0.4 OUTLIER -102.18 137.08 40.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.68 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.67 7.17 6.12 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.011 177.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 1.014 ' HB2' ' HA2' ' A' ' 98' ' ' GLY . . . 69.07 95.94 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.297 0.57 . . . . 0.0 111.448 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' CB ' ' HG2' ' A' ' 72' ' ' GLN . 92.5 mttt -118.68 -35.73 3.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.78 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.62 -4.28 79.27 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.757 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.41 ' HG2' ' CB ' ' A' ' 70' ' ' LYS . 8.2 pt20 -93.11 100.91 13.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.391 0.615 . . . . 0.0 110.363 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 84.2 m95 -71.73 112.09 7.54 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.151 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -135.71 141.77 44.95 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 93.9 m95 -78.86 156.92 28.46 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.78 -0.768 . . . . 0.0 109.891 176.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 p -56.9 -45.18 83.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.36 -174.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -94.03 -158.06 0.6 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -81.83 67.8 7.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.187 0.517 . . . . 0.0 110.118 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.651 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 13.1 m -130.29 113.05 16.96 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-O 121.305 0.574 . . . . 0.0 110.099 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -69.04 154.43 70.59 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.443 2.762 . . . . 0.0 112.025 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.496 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 85.0 t80 -78.16 133.06 37.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.409 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.452 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 27.9 m-80 -102.33 104.22 35.94 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.766 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -64.79 -33.62 52.93 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.838 2.359 . . . . 0.0 112.289 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -80.07 -18.31 50.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.057 0.456 . . . . 0.0 110.738 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.452 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 82.8 mtt180 -119.28 37.66 4.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.092 0.472 . . . . 0.0 110.995 -178.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.525 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.8 p -93.56 127.93 45.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.432 174.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -110.37 72.14 0.78 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.929 0.395 . . . . 0.0 111.117 -173.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -71.4 174.8 6.07 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.428 0.632 . . . . 0.0 111.423 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.595 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 24.9 m-70 -88.0 -168.51 2.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 171.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -126.26 -23.56 3.83 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.602 -0.439 . . . . 0.0 112.015 -174.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -135.68 6.21 3.19 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 108.32 -0.992 . . . . 0.0 108.32 178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.595 ' OE1' ' HB3' ' A' ' 89' ' ' HIS . 4.6 mp0 -118.21 98.75 51.62 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 114.53 -1.214 . . . . 0.0 109.983 -173.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -97.96 -164.06 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 123.558 2.839 . . . . 0.0 113.396 -176.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.431 ' HA ' ' HB2' ' A' ' 115' ' ' ASP . 2.7 m-20 -49.06 130.69 18.91 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.78 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -107.35 3.49 25.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.749 173.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.649 ' HB2' ' HD3' ' A' ' 117' ' ' PRO . 34.3 t -165.52 149.45 8.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -121.91 83.07 2.04 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 173.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 1.014 ' HA2' ' HB2' ' A' ' 69' ' ' ALA . . . 144.2 114.53 0.96 Allowed Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.395 -173.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.481 ' HA ' ' O ' ' A' ' 66' ' ' ASP . 43.7 mt-10 54.55 67.12 1.06 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.21 0.528 . . . . 0.0 109.636 -171.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -102.61 109.0 20.48 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.286 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.2 p -123.24 137.53 54.85 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.968 178.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.63 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 32.0 m -86.55 148.59 4.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.345 0.593 . . . . 0.0 111.71 -175.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.748 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.4 m -122.06 153.66 26.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.401 175.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD21 ' A' ' 62' ' ' LEU . 19.1 mt -83.52 106.45 15.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 171.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.488 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 7.3 p -125.79 146.2 31.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.442 -177.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.605 ' CE1' ' HA ' ' A' ' 109' ' ' ASP . 86.2 t80 -87.93 109.08 19.53 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.79 -177.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.53 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 19.0 m120 -140.77 127.01 19.71 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 178.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 63.21 37.85 10.93 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.42 0.629 . . . . 0.0 109.896 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.605 ' HA ' ' CE1' ' A' ' 106' ' ' TYR . 9.3 t70 73.68 -17.47 0.44 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 114.117 -1.402 . . . . 0.0 111.959 178.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.423 ' NZ ' ' HB2' ' A' ' 112' ' ' ALA . 6.2 pttp -102.22 142.09 34.02 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.494 0.664 . . . . 0.0 111.029 -175.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -84.35 135.6 34.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.421 173.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -157.12 165.93 34.65 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.228 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.63 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 20.3 m0 -76.52 123.77 26.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.446 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.488 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 4.6 t30 -111.74 123.62 50.63 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.431 ' HB2' ' HA ' ' A' ' 94' ' ' ASP . 5.2 m-20 -67.71 123.29 20.09 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.515 0.509 . . . . 0.0 109.871 177.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.474 ' CG2' ' HD2' ' A' ' 117' ' ' PRO . 4.1 p -144.47 146.56 33.13 Favored Pre-proline 0 C--N 1.32 -0.709 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -177.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.649 ' HD3' ' HB2' ' A' ' 96' ' ' SER . 11.6 Cg_endo -57.12 133.29 56.73 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 121.932 1.754 . . . . 0.0 111.324 174.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 85.0 m -64.39 -9.36 17.6 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.9 m-80 -96.68 22.64 7.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.03 0.443 . . . . 0.0 110.719 177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 23' ' ' THR . 74.1 t80 -99.76 128.04 45.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.698 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.672 ' OE2' HG23 ' A' ' 23' ' ' THR . 45.1 mm-40 -73.67 123.22 23.65 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.519 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -152.05 178.99 8.87 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 176.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.1 m -72.96 168.77 18.31 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -148.19 150.27 33.45 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.998 0.428 . . . . 0.0 112.003 -170.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.754 HG13 ' HB3' ' A' ' 60' ' ' TYR . 54.6 mt -116.91 125.15 73.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.271 173.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.7 t -103.25 126.61 50.5 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -128.9 127.23 41.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.768 -171.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.56 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.8 tt -132.15 141.97 43.34 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.58 157.26 62.6 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 121.942 1.761 . . . . 0.0 110.864 171.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.812 ' HA3' ' HG3' ' A' ' 1' ' ' MET . . . -75.36 58.03 2.85 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.215 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.3 t -87.03 19.31 3.12 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.125 0.57 . . . . 0.0 110.914 -174.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -28.79 58.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.266 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 89.5 mt -70.18 -31.7 69.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.13 0.491 . . . . 0.0 110.619 -178.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.01 -39.74 14.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.307 0.575 . . . . 0.0 110.121 177.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.546 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.83 38.3 0.91 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.728 -177.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.2 -46.86 79.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.729 0.3 . . . . 0.0 111.576 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.574 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 57.1 t30 -75.22 -30.01 60.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.454 -177.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.546 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 6.9 tt -64.64 -48.19 75.74 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 177.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -70.26 -20.66 63.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.274 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -75.2 -32.25 61.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.508 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 78.3 mm-40 -87.39 -6.4 58.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.93 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.998 -176.434 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.5 mtt . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.8 m -113.8 170.57 4.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 169.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.629 ' HB2' ' HB2' ' A' ' 7' ' ' TRP . 6.0 p -119.65 116.01 33.46 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-O 121.099 0.476 . . . . 0.0 111.209 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 3' ' ' CYS . 44.3 Cg_endo -68.4 171.13 13.43 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.135 2.557 . . . . 0.0 111.292 174.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 35.7 mt -70.44 70.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.539 0.685 . . . . 0.0 111.184 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -166.96 -42.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.629 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 37.3 m95 -62.41 119.31 8.86 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 164.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -72.43 109.22 5.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.915 0.388 . . . . 0.0 110.783 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.99 121.48 25.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.251 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.612 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 85.5 t80 -139.15 129.87 26.07 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.447 ' HG3' ' CD2' ' A' ' 10' ' ' PHE . 52.0 mt-30 66.03 -82.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.697 0.623 . . . . 0.0 110.345 -175.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -152.19 8.64 0.48 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.742 178.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.439 ' OD1' ' HA ' ' A' ' 129' ' ' PRO . 60.5 m-80 -116.98 166.64 11.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.405 -174.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.745 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 4.1 m -118.03 127.49 53.86 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.612 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 35.7 m-85 -122.52 133.13 54.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.497 0.189 . . . . 0.0 111.034 -174.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 52.5 t80 -140.34 117.35 8.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.857 175.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 1.1 Cg_endo -84.22 137.43 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.376 2.717 . . . . 0.0 112.105 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.472 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mp -129.44 140.01 51.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.1 p -101.65 21.94 13.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.947 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.52 149.18 50.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.498 178.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -83.27 97.67 9.0 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 170.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -143.79 145.91 32.71 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.068 0.461 . . . . 0.0 111.065 -172.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.0 p -80.78 173.78 12.27 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.708 173.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 9.6 t90 -65.25 -35.91 82.48 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -64.0 -48.9 74.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.832 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -62.93 -44.11 96.97 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.246 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.408 ' HB2' HD11 ' A' ' 38' ' ' LEU . 10.9 p -65.13 -33.1 75.22 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.967 -0.293 . . . . 0.0 110.647 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.491 ' HA ' HD21 ' A' ' 38' ' ' LEU . 27.2 tt0 -61.57 -37.82 85.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.639 174.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 15.6 mmm180 -84.49 -36.81 21.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.403 -176.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -74.0 -37.92 64.26 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.122 0.487 . . . . 0.0 110.314 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.5 m -84.81 177.23 8.07 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 169.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.744 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 18.8 m 75.77 -48.48 0.6 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 122.497 0.319 . . . . 0.0 110.594 -175.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -60.88 -30.68 73.65 Favored Glycine 0 CA--C 1.518 0.273 0 C-N-CA 121.288 -0.482 . . . . 0.0 112.229 175.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 77.7 mtm -80.32 4.16 18.72 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.984 0.421 . . . . 0.0 110.788 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.72 51.76 7.76 Favored Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.744 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -147.02 -175.49 4.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.086 -0.557 . . . . 0.0 109.91 -173.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -149.29 170.43 18.53 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 175.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 28' ' ' GLU . 4.2 mm? -63.59 157.6 23.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.842 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -61.55 96.41 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.394 0.616 . . . . 0.0 111.586 -177.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -101.35 98.34 8.72 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.466 176.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.408 HD11 HD11 ' A' ' 104' ' ' LEU . 52.8 mt -64.6 115.51 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.669 -177.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.35 -28.13 16.36 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.103 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.623 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 25.5 p -141.38 154.91 45.91 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.532 0.682 . . . . 0.0 111.652 179.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -67.41 -37.49 83.14 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.204 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.401 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -59.82 -41.44 91.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.115 0.484 . . . . 0.0 109.999 176.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' O ' ' A' ' 43' ' ' THR . 70.3 tt0 -51.5 -51.99 50.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.593 174.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.403 ' HA ' HG22 ' A' ' 50' ' ' ILE . 53.0 tt0 -58.08 -50.4 73.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.068 178.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -56.8 -30.85 64.1 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 112.234 -176.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.466 ' HA ' HE21 ' A' ' 52' ' ' GLN . 36.6 m-85 -88.53 -39.31 14.25 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.07 -28.56 39.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.377 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.49 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.9 pt -70.3 -8.8 11.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.963 0.411 . . . . 0.0 111.403 -179.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.466 HE21 ' HA ' ' A' ' 49' ' ' PHE . 50.2 mt-30 -87.68 -18.21 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.308 174.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -93.03 -20.25 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.068 176.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 82.3 mt -81.84 130.27 35.01 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.994 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.546 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.3 t70 -64.5 136.61 57.23 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 172.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.471 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 84.9 mtt180 -86.99 15.97 5.44 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -169.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.637 ' HG2' HD22 ' A' ' 58' ' ' LEU . 9.8 ptp85 -113.62 -11.99 12.92 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.304 -0.559 . . . . 0.0 111.083 174.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.637 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.3 mm? -99.24 164.56 12.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.284 0.564 . . . . 0.0 111.717 -179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.6 m -120.63 114.4 21.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.254 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 125' ' ' ILE . 47.7 m-85 -102.51 126.62 49.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.587 0.218 . . . . 0.0 111.587 -170.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.785 ' HA ' HG12 ' A' ' 103' ' ' VAL . 33.2 m-85 -62.14 139.87 58.45 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.962 0.41 . . . . 0.0 111.707 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.475 HD21 ' HG ' ' A' ' 104' ' ' LEU . 73.5 mt -105.02 158.56 16.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.145 175.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.4 ' CA ' ' HB3' ' A' ' 38' ' ' LEU . . . -83.2 53.89 4.91 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 114.461 0.544 . . . . 0.0 114.461 -170.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.664 HD21 HG22 ' A' ' 102' ' ' VAL . 2.3 pt? -135.36 150.24 49.89 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -153.35 144.32 22.87 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.433 0.635 . . . . 0.0 111.401 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.825 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 30.7 t70 -107.98 93.57 4.61 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 162.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 3.4 tm-20 -64.97 112.74 3.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.955 -1.021 . . . . 0.0 111.87 -167.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 52.99 34.8 17.77 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.642 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.41 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 66.79 92.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.617 0.723 . . . . 0.0 112.046 175.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 41.3 mttp -126.13 -13.52 6.19 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 177.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 75.01 19.73 79.78 Favored Glycine 0 N--CA 1.45 -0.413 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.099 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.79 93.74 4.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.477 0.656 . . . . 0.0 110.706 -178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 90.6 m95 -71.8 103.24 3.06 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.541 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -147.92 155.62 41.78 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.821 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.618 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 80.0 m95 -81.93 168.6 17.73 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 176.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.09 -34.22 67.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -175.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -116.09 79.23 1.28 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 70.79 -50.0 0.67 Allowed 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.066 173.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 18.7 m -47.41 124.1 9.07 Favored Pre-proline 0 C--N 1.329 -0.322 0 C-N-CA 123.361 0.665 . . . . 0.0 112.548 -170.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.4 Cg_exo -71.63 153.55 59.8 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 123.168 2.579 . . . . 0.0 111.625 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.51 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 87.4 t80 -61.52 147.06 46.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.366 178.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.496 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 50.6 m-80 -98.8 100.04 8.9 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.844 -179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.51 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 74.0 Cg_endo -79.65 -24.95 5.77 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.355 2.037 . . . . 0.0 112.011 178.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -91.16 -7.79 50.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.134 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 78.4 mtm180 -134.59 44.97 2.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.12 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 p -95.28 131.55 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.143 0.497 . . . . 0.0 109.839 177.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -115.65 74.5 0.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.893 -175.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -75.12 -179.52 4.42 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.681 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 90.9 m-70 -89.97 -70.41 0.67 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.405 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.608 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 1.6 tmtm? 166.96 -30.12 0.0 OUTLIER 'General case' 0 C--O 1.235 0.32 0 O-C-N 124.037 0.835 . . . . 0.0 110.028 -177.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.608 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 2.4 t30 -144.04 61.45 1.36 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.26 -174.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.464 ' OE2' ' HB2' ' A' ' 89' ' ' HIS . 3.0 mm-40 -63.9 144.5 98.06 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.759 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.22 -65.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.007 2.471 . . . . 0.0 113.032 -176.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -163.49 159.66 22.34 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.38 103.84 14.66 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 176.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.9 m -51.06 108.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.566 0.698 . . . . 0.0 111.893 -174.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.553 ' H ' ' CD ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -79.74 19.82 0.64 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.395 -178.305 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -162.08 111.19 0.47 Allowed Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.711 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 5.9 mm-40 55.75 83.93 0.09 Allowed 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 121.423 0.63 . . . . 0.0 110.848 -171.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.825 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 3.1 t-20 -101.09 124.79 47.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.205 -171.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.7 p -157.0 166.1 34.3 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.273 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.664 HG22 HD21 ' A' ' 64' ' ' LEU . 1.3 m -115.96 153.86 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.888 -176.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 ' HA ' ' A' ' 61' ' ' PHE . 23.1 m -124.88 153.47 31.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.132 177.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.475 ' HG ' HD21 ' A' ' 62' ' ' LEU . 23.4 mt -84.55 109.67 18.12 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 171.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.7 p -130.0 143.24 41.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.562 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -84.25 102.42 12.64 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.446 177.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.681 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 19.3 t-20 -147.47 136.73 22.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.668 -176.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.477 ' HG3' ' OD1' ' A' ' 107' ' ' ASN . 25.3 mt-30 69.94 31.81 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.994 0.808 . . . . 0.0 109.092 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.9 t0 63.52 22.11 13.05 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.362 177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.61 152.76 40.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.66 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.49 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -77.54 138.4 39.16 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.547 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -166.99 165.62 15.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.621 0.248 . . . . 0.0 110.95 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 31.5 m0 -77.74 135.31 38.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.55 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.431 HD22 HG13 ' A' ' 116' ' ' VAL . 6.2 t30 -125.36 135.85 52.85 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 175.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -73.31 124.7 26.22 Favored 'General case' 0 C--N 1.324 -0.532 0 O-C-N 123.388 0.43 . . . . 0.0 110.393 -179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.431 HG13 HD22 ' A' ' 114' ' ' ASN . 17.1 m -143.52 156.42 60.17 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.893 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -67.5 132.18 26.56 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.237 1.958 . . . . 0.0 110.907 171.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.711 ' HB2' ' HB3' ' A' ' 99' ' ' GLU . 81.9 m -62.37 -21.56 65.43 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.932 0.396 . . . . 0.0 111.309 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -94.93 64.37 2.83 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.496 0.665 . . . . 0.0 110.099 176.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -140.65 139.91 34.91 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.082 -0.963 . . . . 0.0 109.21 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -78.3 110.83 13.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.143 0.497 . . . . 0.0 111.22 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.487 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -147.76 179.09 7.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.457 175.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 12.9 p -80.54 174.59 11.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.784 0.326 . . . . 0.0 110.402 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.472 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 19.1 ptt180 -144.96 156.35 43.92 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.039 0.447 . . . . 0.0 111.564 -171.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.842 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 30.6 mt -122.41 131.62 72.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 170.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.8 t -103.04 124.22 48.1 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.599 ' HB2' ' HA ' ' A' ' 39' ' ' MET . 19.7 tptm -112.28 111.75 22.85 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.504 -172.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.745 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 38.1 mt -96.85 124.35 50.41 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.553 174.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.439 ' HA ' ' OD1' ' A' ' 13' ' ' ASN . 40.3 Cg_endo -69.07 168.74 19.78 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.673 2.249 . . . . 0.0 111.279 177.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -64.59 37.69 0.1 OUTLIER Glycine 0 CA--C 1.526 0.754 0 N-CA-C 114.497 0.559 . . . . 0.0 114.497 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 129' ' ' PRO . 7.2 t -77.54 -17.53 57.84 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 27.0 m -62.93 -30.45 71.56 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.941 173.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 85.7 mt -74.45 -29.17 61.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.479 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -79.68 -29.2 40.74 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.569 0.699 . . . . 0.0 109.631 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.628 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -89.96 44.75 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.338 176.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.67 -55.02 34.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.898 -175.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 7.5 m-80 -71.84 -27.16 62.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.049 0.452 . . . . 0.0 110.221 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.628 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tm? -60.35 -47.52 85.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.535 177.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -75.39 -28.12 59.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.571 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.471 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 85.2 t80 -63.36 -25.76 68.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.823 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.1 mt-30 -79.24 -8.6 59.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.592 178.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.742 -0.647 . . . . 0.0 110.867 -177.567 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.488 ' N ' ' HA2' ' A' ' 130' ' ' GLY . 2.0 mpt? . . . . . 0 N--CA 1.484 1.253 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 68.0 t -85.57 118.17 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 172.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 73.6 m -144.18 172.38 5.57 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.777 -172.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.569 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 51.4 Cg_exo -53.71 160.88 4.98 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.473 2.115 . . . . 0.0 112.439 176.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.567 ' H ' HD12 ' A' ' 5' ' ' ILE . 3.5 mp -58.92 135.11 23.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.814 -174.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.0 t70 81.4 -18.51 0.48 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.375 1.07 . . . . 0.0 112.383 173.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.569 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 28.4 m95 -58.97 121.11 10.39 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 175.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 5.2 mpt_? -72.96 103.28 3.71 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.371 -175.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.14 120.85 21.21 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.443 177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -128.24 104.77 7.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 61.44 -82.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.612 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.0 m -110.63 -37.27 5.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.562 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -101.89 173.25 6.49 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.745 -170.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.562 ' HB2' ' CG2' ' A' ' 128' ' ' ILE . 58.0 m -135.57 131.28 35.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 176.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 127' ' ' LYS . 69.6 m-85 -118.25 126.14 51.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.815 0.341 . . . . 0.0 111.809 -172.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.49 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 67.0 t80 -111.99 119.61 43.9 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.946 177.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.3 Cg_endo -85.65 134.23 4.64 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.2 2.6 . . . . 0.0 112.184 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 138.66 54.6 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.85 0.357 . . . . 0.0 110.179 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.4 p -88.68 -4.76 58.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.261 0.553 . . . . 0.0 109.916 174.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 123' ' ' SER . 3.6 t70 -56.0 139.06 47.81 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.356 178.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 13.6 m120 -92.82 105.35 17.5 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.198 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.609 ' HG3' ' HB2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -139.19 154.08 48.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.775 -178.443 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.5 ' OG1' ' HG2' ' A' ' 26' ' ' GLU . 57.4 p -80.11 168.59 18.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.403 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 23.4 t90 -59.92 -39.83 86.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.041 0.448 . . . . 0.0 110.41 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.12 -48.7 50.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.354 -178.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.609 ' HB2' ' HG3' ' A' ' 22' ' ' LYS . 12.0 mm-40 -69.38 -28.81 66.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.673 0.273 . . . . 0.0 110.821 -177.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.569 ' HB3' HD21 ' A' ' 38' ' ' LEU . 73.2 m -57.94 -45.68 86.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.985 173.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.493 ' HA ' ' OE1' ' A' ' 28' ' ' GLU . 6.6 mm-40 -74.78 -18.77 60.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.701 0.286 . . . . 0.0 111.452 177.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -73.84 -35.31 64.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.802 0.334 . . . . 0.0 110.923 172.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -85.15 -38.91 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.525 0.679 . . . . 0.0 110.022 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 32' ' ' SER . 90.3 m -87.49 179.15 6.61 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.434 -0.803 . . . . 0.0 108.97 174.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.799 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 62.0 m 73.59 -43.0 0.54 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.482 0.313 . . . . 0.0 111.496 -177.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.12 -22.94 65.57 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 121.013 -0.613 . . . . 0.0 111.907 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.9 mtm -87.51 12.47 12.26 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.162 0.185 . . . . 0.0 110.768 177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.457 ' O ' HG13 ' A' ' 128' ' ' ILE . . . 72.61 38.93 57.07 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 110.331 -1.107 . . . . 0.0 110.331 -172.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.799 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -134.02 -174.27 3.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.949 -0.626 . . . . 0.0 110.512 -171.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -159.31 168.08 27.29 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 176.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.569 HD21 ' HB3' ' A' ' 27' ' ' SER . 41.2 mt -64.79 146.79 54.33 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.378 0.535 . . . . 0.0 110.799 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.434 ' HG3' ' CE2' ' A' ' 15' ' ' TYR . 23.5 ttt -59.05 126.13 26.43 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-O 121.451 0.643 . . . . 0.0 111.972 -176.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.513 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 33.4 p -118.72 106.96 13.1 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.717 173.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 48.6 mt -58.5 104.23 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.733 -176.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.8 m -89.7 -31.36 17.51 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.789 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 27.3 p -137.42 152.35 49.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.531 0.682 . . . . 0.0 111.604 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -61.17 -43.41 98.93 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.688 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.438 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -60.59 -37.15 80.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.497 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.472 ' HB3' ' O ' ' A' ' 43' ' ' THR . 40.1 tt0 -55.05 -51.39 66.48 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.386 177.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' ILE . 48.1 tt0 -60.03 -47.34 86.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.695 176.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -57.34 -35.26 69.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.889 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.655 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 35.8 m-85 -84.4 -29.2 26.38 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.549 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.4 tp -78.62 -31.1 15.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.047 -178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.42 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 32.5 pt -72.48 -4.38 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -176.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 2.7 pt20 -87.88 -20.42 26.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 175.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -94.38 -30.14 14.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.286 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 81.9 mt -71.09 144.19 50.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.559 -176.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.519 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -76.06 131.85 39.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.381 176.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.562 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 76.7 mtt180 -84.43 27.47 0.7 Allowed 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -170.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.817 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.0 ptp180 -126.95 -13.78 5.69 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.699 0.285 . . . . 0.0 110.848 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.817 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -97.66 157.57 15.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.225 0.536 . . . . 0.0 112.039 -177.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 p -108.96 115.55 30.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.682 174.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB3' HG13 ' A' ' 125' ' ' ILE . 96.2 m-85 -99.55 123.86 44.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -61.39 139.06 58.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.997 0.427 . . . . 0.0 111.824 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 97.5 mt -114.42 175.49 5.46 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.145 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.08 -2.37 90.43 Favored Glycine 0 CA--C 1.521 0.468 0 C-N-CA 120.903 -0.665 . . . . 0.0 114.407 -174.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.492 ' HB2' HG22 ' A' ' 102' ' ' VAL . 15.0 mt -79.68 127.48 32.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 117.809 0.804 . . . . 0.0 110.742 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HG3' ' SG ' ' A' ' 101' ' ' CYS . 35.0 ttt180 -137.63 129.02 28.03 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.436 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 19.0 t70 -94.5 147.27 23.43 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 161.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -145.03 26.77 1.33 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -179.54 14.27 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 121.021 -0.272 . . . . 0.0 111.249 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.59 32.33 21.68 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -167.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.9 ptpp? -85.26 -19.42 31.63 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.741 -173.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 71.32 5.71 59.96 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.397 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -86.58 82.93 7.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 98.7 m95 -69.34 105.88 2.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.362 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 26.4 ptt180 -126.43 146.0 50.25 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.729 177.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.54 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 76.5 m95 -84.91 139.56 31.76 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.47 -11.8 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.142 0.496 . . . . 0.0 111.689 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.508 ' HB3' HG21 ' A' ' 40' ' ' THR . 32.6 t70 -99.41 29.24 4.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.306 0.574 . . . . 0.0 109.989 -179.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.36 -12.31 0.73 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.33 177.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.3 m -59.38 131.33 87.83 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.113 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.1 Cg_exo -73.97 159.51 44.61 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.889 2.393 . . . . 0.0 112.044 177.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.449 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 52.6 t80 -71.29 139.0 49.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.559 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -90.46 114.76 62.27 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.109 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.526 ' O ' ' HD2' ' A' ' 84' ' ' ARG . 6.8 Cg_exo -74.7 -12.32 22.17 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.115 2.543 . . . . 0.0 112.899 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.526 ' HD2' ' O ' ' A' ' 83' ' ' PRO . 0.6 OUTLIER -123.89 -43.99 2.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.881 0.372 . . . . 0.0 110.764 178.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -84.05 52.22 2.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.025 0.441 . . . . 0.0 109.842 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 7.5 p -98.21 -33.56 4.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.567 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 68.44 -65.19 0.28 Allowed 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.424 0.689 . . . . 0.0 112.67 172.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.418 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 39.7 m95 53.89 -169.06 0.06 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.586 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 1.5 t-80 -99.61 -18.12 17.48 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.195 -0.912 . . . . 0.0 109.896 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.547 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 1.7 tttm 83.56 -5.21 1.17 Allowed 'General case' 0 N--CA 1.472 0.652 0 O-C-N 124.336 1.022 . . . . 0.0 110.942 176.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -168.92 72.48 0.09 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.9 0.857 . . . . 0.0 109.998 176.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' OE1' ' HB3' ' A' ' 88' ' ' TRP . 0.4 OUTLIER -123.95 146.13 50.04 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.651 -177.423 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 94.5 Cg_endo -96.62 -170.36 0.15 Allowed 'Trans proline' 0 N--CA 1.451 -1.007 0 C-N-CA 123.059 2.506 . . . . 0.0 112.044 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -123.62 101.37 7.27 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 172.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -103.11 -30.8 10.5 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.405 0.622 . . . . 0.0 110.073 -178.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.9 t -92.53 63.51 4.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.852 -178.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -69.47 95.44 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.543 0.687 . . . . 0.0 110.761 177.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 149.15 -71.45 0.31 Allowed Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.513 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 29.8 mt-10 -116.54 81.82 1.69 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 172.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.436 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 47.3 t-20 -91.16 99.78 12.73 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.255 0.55 . . . . 0.0 109.917 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' ' HG3' ' A' ' 65' ' ' ARG . 29.8 m -103.5 136.47 43.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.123 174.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.634 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 26.8 m -93.25 138.78 19.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.152 0.501 . . . . 0.0 110.961 -179.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.61 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.5 m -116.26 147.5 19.6 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.712 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.43 ' HG ' ' CE3' ' A' ' 111' ' ' TRP . 22.6 tp -83.18 101.88 11.5 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -124.76 141.23 45.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.063 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.562 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 38.0 t80 -86.34 99.32 11.52 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.505 178.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -142.32 136.74 29.99 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 66.22 28.14 10.11 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -171.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.2 t70 72.0 -3.04 2.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.694 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 112' ' ' ALA . 0.0 OUTLIER -113.45 143.31 44.72 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.787 -0.57 . . . . 0.0 110.964 178.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.43 ' CE3' ' HG ' ' A' ' 104' ' ' LEU . 93.4 m95 -69.28 130.19 41.91 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 169.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.586 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -149.58 166.54 28.95 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.029 -175.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.634 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 42.9 m0 -96.37 119.36 34.72 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.264 176.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 1.8 t30 -104.45 146.16 29.25 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -75.86 136.38 40.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 101' ' ' CYS . 4.5 p -158.67 143.84 11.91 Favored Pre-proline 0 C--N 1.317 -0.806 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.2 129.09 29.74 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.058 1.839 . . . . 0.0 110.609 173.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.513 ' SG ' ' HB3' ' A' ' 99' ' ' GLU . 61.1 m -57.44 -28.21 63.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.219 0.533 . . . . 0.0 110.261 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -90.85 70.66 6.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.287 0.565 . . . . 0.0 109.991 170.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.46 ' O ' ' HA ' ' A' ' 23' ' ' THR . 83.9 t80 -138.14 133.69 33.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.528 175.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 28.2 mp0 -74.62 109.72 8.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.052 0.453 . . . . 0.0 110.629 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -142.84 179.62 6.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.027 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 20' ' ' ASP . 48.9 m -74.35 168.47 19.61 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.786 0.327 . . . . 0.0 110.656 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 11.3 ttm180 -137.06 147.82 46.39 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.695 -167.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.591 HG13 ' HB3' ' A' ' 60' ' ' TYR . 50.3 mt -132.23 122.23 47.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 168.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.407 ' SG ' HD23 ' A' ' 38' ' ' LEU . 82.4 m -118.09 143.54 46.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.221 0.534 . . . . 0.0 111.279 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.496 ' HB3' ' CE2' ' A' ' 15' ' ' TYR . 22.2 ptmt -112.97 143.02 44.98 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.5 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.562 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 10.0 tt -118.57 136.26 24.03 Favored Pre-proline 0 C--N 1.314 -0.948 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.41 ' HG2' HG23 ' A' ' 131' ' ' THR . 19.3 Cg_endo -59.91 166.95 7.77 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.472 2.115 . . . . 0.0 111.96 175.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.488 ' HA2' ' N ' ' A' ' 1' ' ' MET . . . -44.14 -39.76 5.45 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 113.552 178.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.41 HG23 ' HG2' ' A' ' 129' ' ' PRO . 7.7 p 58.98 -12.07 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 173.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 24.2 p -58.91 -51.77 68.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.601 0.239 . . . . 0.0 110.648 177.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 57.6 mt -54.26 -24.33 18.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.739 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -87.1 -52.17 5.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.231 0.539 . . . . 0.0 110.229 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.01 22.48 3.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.49 -175.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 132' ' ' THR . 60.2 mm-40 -48.83 -66.14 0.45 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.067 0.46 . . . . 0.0 111.685 -177.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.438 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 92.4 m-20 -74.72 -27.51 60.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 -177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.0 -46.22 90.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.76 -24.43 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.175 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.432 ' HB3' ' HA ' ' A' ' 137' ' ' ASN . 86.5 t80 -67.15 -24.91 65.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.903 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 23.7 mt-30 -85.24 -5.19 59.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.439 178.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.831 -177.721 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.513 ' HA ' ' OG1' ' A' ' 132' ' ' THR . 28.1 ttt . . . . . 0 N--CA 1.48 1.062 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.763 ' H ' ' HB ' ' A' ' 132' ' ' THR . 52.7 t -122.29 125.22 72.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.993 0.425 . . . . 0.0 111.342 -177.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 m -132.44 167.59 21.83 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 172.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.704 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 44.4 Cg_exo -56.66 163.32 7.21 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.221 1.947 . . . . 0.0 112.007 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.4 tp -56.87 122.15 5.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -171.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.3 t70 66.37 6.18 4.16 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.262 -1.335 . . . . 0.0 112.83 176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.704 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 14.5 m95 -63.27 122.95 17.43 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 170.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.594 ' HB3' ' HB2' ' A' ' 15' ' ' TYR . 4.8 tpp180 -72.24 97.59 2.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.015 -165.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.477 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -76.42 121.78 23.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.051 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.412 ' HB3' ' OD1' ' A' ' 13' ' ' ASN . 85.1 t80 -132.2 102.21 5.69 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.864 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 67.68 -71.59 0.1 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.196 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -145.88 13.53 1.32 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.754 0.311 . . . . 0.0 111.47 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 26.0 p30 -132.29 169.26 16.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.437 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 92.6 m -139.77 133.87 31.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.965 0.412 . . . . 0.0 110.012 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.815 ' HE2' ' HG2' ' A' ' 39' ' ' MET . 45.4 m-85 -115.03 142.52 46.52 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -170.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -127.72 113.23 20.72 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.003 169.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -89.92 122.95 1.1 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 123.095 2.53 . . . . 0.0 112.148 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.506 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.6 mp -112.94 138.8 49.26 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.903 0.382 . . . . 0.0 110.099 179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.8 p -105.65 9.5 33.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.497 -176.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -82.38 136.29 35.0 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.973 0.416 . . . . 0.0 110.015 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.813 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 16.2 m120 -71.49 100.32 2.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.422 -176.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.535 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 21.2 mmmt -127.24 149.66 49.9 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.386 177.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 61.7 p -75.21 165.58 24.98 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CZ3' ' HD2' ' A' ' 65' ' ' ARG . 68.4 t90 -56.81 -39.04 73.44 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.114 0.483 . . . . 0.0 110.276 -179.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.648 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -63.66 -50.88 67.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.91 -179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -64.84 -36.83 85.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.157 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.1 t -51.35 -47.82 62.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.189 174.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -74.82 -21.07 59.5 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.175 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 34.1 mmt-85 -82.7 -32.66 27.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.703 0.287 . . . . 0.0 111.339 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -83.32 -38.82 21.58 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.107 0.479 . . . . 0.0 109.916 178.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.577 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 96.8 m -85.68 177.8 7.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.798 175.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 35.7 m 76.88 -33.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 123.812 0.845 . . . . 0.0 110.511 -172.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -62.84 -32.75 84.91 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 121.394 -0.431 . . . . 0.0 112.471 173.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.577 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.7 pmm? -95.25 1.63 54.63 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.956 0.378 . . . . 0.0 110.448 177.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 96.03 -6.41 66.62 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.791 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.516 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -95.02 140.16 30.35 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.487 ' HD2' ' OD2' ' A' ' 77' ' ' ASP . 33.0 t60 -118.66 165.51 13.89 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -175.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -46.04 133.96 8.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.988 0.423 . . . . 0.0 111.552 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.815 ' HG2' ' HE2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -58.54 103.73 0.17 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.492 0.663 . . . . 0.0 111.03 178.876 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.651 ' HA ' ' HZ3' ' A' ' 75' ' ' TRP . 2.0 t -94.3 118.91 32.3 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.412 168.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.712 HD13 ' HE1' ' A' ' 39' ' ' MET . 25.3 mm -61.3 119.95 6.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.4 m -102.75 -45.45 5.0 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.0 p -136.98 163.08 31.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.118 0.485 . . . . 0.0 111.244 -179.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -64.88 -40.56 95.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.052 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.408 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -63.47 -45.48 90.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.195 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -54.15 -50.45 66.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.726 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.5 tp60 -51.7 -50.36 60.65 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.638 176.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -66.26 -41.43 89.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.951 -177.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.408 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 26.1 m-85 -70.19 -41.29 73.89 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.806 0.298 . . . . 0.0 111.806 -178.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.3 tp -69.96 -34.07 58.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.548 -175.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.44 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 33.8 pt -71.91 -3.26 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 120.885 0.374 . . . . 0.0 111.349 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -87.46 -23.96 24.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 174.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.416 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 72.9 m-85 -93.14 -21.21 19.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.212 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -73.89 142.48 46.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.5 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 15.1 t70 -67.97 119.61 12.9 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.444 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 18.3 mtt180 -71.33 60.61 0.3 Allowed 'General case' 0 C--N 1.326 -0.419 0 O-C-N 123.449 0.468 . . . . 0.0 111.742 -177.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 1.9 ttp180 -162.54 -29.32 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.293 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.436 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -92.35 173.98 7.53 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.381 0.61 . . . . 0.0 111.948 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.6 p -122.0 129.51 52.53 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.145 174.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.677 ' HB3' HG13 ' A' ' 125' ' ' ILE . 68.0 m-85 -114.17 126.23 54.83 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.546 0.202 . . . . 0.0 111.546 -173.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.643 ' HA ' HG12 ' A' ' 103' ' ' VAL . 38.7 m-85 -61.98 146.94 48.62 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 178.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 72.1 mt -113.64 176.77 4.89 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.468 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.92 6.18 67.59 Favored Glycine 0 CA--C 1.527 0.807 0 N-CA-C 115.764 1.066 . . . . 0.0 115.764 -169.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.744 HD23 ' H ' ' A' ' 64' ' ' LEU . 1.4 pt? -103.48 138.54 40.05 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 118.861 1.331 . . . . 0.0 110.894 179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.423 ' HD2' ' CZ3' ' A' ' 24' ' ' TRP . 30.3 ttt180 -136.86 137.81 40.09 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -173.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.711 ' HA ' ' HE2' ' A' ' 70' ' ' LYS . 7.6 t0 -109.82 154.22 23.3 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 161.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.47 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 2.9 pt-20 -145.02 -1.79 0.83 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -167.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -157.32 26.22 0.3 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 56.96 45.76 20.68 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.52 0.676 . . . . 0.0 109.229 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 66' ' ' ASP . 35.9 mtmt -70.04 -47.29 62.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.104 -173.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.24 -26.76 8.35 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -173.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -89.14 100.06 12.92 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.092 -0.554 . . . . 0.0 109.615 176.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.537 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 92.1 m95 -70.97 142.83 51.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.579 0.704 . . . . 0.0 112.089 -175.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 22.6 tpt180 -140.47 120.12 13.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.699 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.651 ' HZ3' ' HA ' ' A' ' 40' ' ' THR . 40.7 m95 -79.15 147.21 32.77 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.912 175.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.2 p -75.01 -13.21 15.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.504 0.669 . . . . 0.0 109.996 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 4.6 m-20 -90.07 18.99 5.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.049 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 47.1 tp60 76.53 -19.72 0.4 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.231 0.612 . . . . 0.0 111.403 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.9 m -55.73 127.42 67.41 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 120.986 0.422 . . . . 0.0 111.556 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -72.55 158.94 50.08 Favored 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.532 2.155 . . . . 0.0 110.464 170.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.537 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 64.0 t80 -64.49 117.88 7.97 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.685 -178.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.563 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -90.72 110.79 43.96 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.706 177.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -69.99 -20.69 33.44 Favored 'Trans proline' 0 CA--C 1.529 0.252 0 C-N-CA 122.521 2.147 . . . . 0.0 112.444 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -104.55 2.88 31.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.523 -179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.563 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 3.6 mmp_? -123.2 22.48 9.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.116 0.484 . . . . 0.0 110.001 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.486 HG23 ' CZ3' ' A' ' 113' ' ' TRP . 14.6 p -99.52 140.75 18.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.174 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -124.15 74.11 1.28 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.82 0.343 . . . . 0.0 110.735 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -63.5 156.55 25.98 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.223 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.602 ' HA ' ' CB ' ' A' ' 112' ' ' ALA . 27.1 t-80 -70.73 -65.36 0.74 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.535 -172.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 16.3 mtpt -154.65 -79.99 0.09 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.73 0.776 . . . . 0.0 109.026 177.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -153.68 23.45 0.52 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.462 ' OE1' ' HB2' ' A' ' 90' ' ' LYS . 6.1 mp0 -57.72 135.07 82.84 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.529 -178.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 9.0 Cg_exo -72.19 146.49 46.11 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 123.217 2.611 . . . . 0.0 112.645 -177.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -81.41 179.67 7.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.24 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.446 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 3.8 p30 -170.82 92.83 0.18 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.562 0.696 . . . . 0.0 110.843 178.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 44.5 t -161.96 167.76 24.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.884 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -127.63 12.24 6.85 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.651 177.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 171.0 -64.92 0.16 Allowed Glycine 0 N--CA 1.444 -0.814 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.83 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -85.9 92.32 8.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.5 0.666 . . . . 0.0 110.763 -179.232 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -108.03 115.0 29.32 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.143 0.497 . . . . 0.0 110.207 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -120.51 138.97 53.55 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.507 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.464 ' CG2' HD21 ' A' ' 64' ' ' LEU . 2.1 m -88.74 147.7 5.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.218 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 61' ' ' PHE . 29.0 m -127.43 154.47 37.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.639 176.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 56.9 mt -82.87 102.96 11.99 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 170.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.6 p -109.33 142.29 22.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.802 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.4 ' CZ ' ' HA ' ' A' ' 109' ' ' ASP . 91.6 t80 -91.33 114.29 26.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.741 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.518 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -151.3 122.55 7.77 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.055 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 61.31 47.41 6.95 Favored 'General case' 0 CA--C 1.518 -0.264 0 O-C-N 123.981 0.8 . . . . 0.0 110.017 -176.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.4 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 13.6 t70 73.44 -28.3 0.19 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 114.375 -1.284 . . . . 0.0 111.936 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -97.7 130.31 44.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.78 0.8 . . . . 0.0 112.383 -171.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.444 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 88.1 m95 -79.42 148.81 31.81 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.462 171.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.602 ' CB ' ' HA ' ' A' ' 89' ' ' HIS . . . -177.09 177.15 1.29 Allowed 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.394 0.434 . . . . 0.0 111.012 173.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.486 ' CZ3' HG23 ' A' ' 86' ' ' VAL . 8.9 m0 -78.97 134.74 36.81 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.936 -178.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -136.19 137.65 41.1 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -79.89 125.04 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.043 0.449 . . . . 0.0 111.343 -177.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.47 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 23.0 m -143.91 160.12 51.0 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.643 177.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.568 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 15.9 Cg_endo -58.58 140.36 94.45 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.096 1.864 . . . . 0.0 111.365 175.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.461 ' HB2' ' HB2' ' A' ' 99' ' ' GLU . 61.6 m -72.02 -23.71 61.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.808 0.337 . . . . 0.0 110.497 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -94.66 53.21 1.61 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.53 0.681 . . . . 0.0 110.273 174.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.568 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 66.8 t80 -123.64 125.64 45.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.309 176.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.813 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 1.8 mp0 -68.75 109.3 3.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.974 0.416 . . . . 0.0 110.98 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.465 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -142.52 -177.94 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.877 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 37.9 m -80.53 172.21 14.05 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.789 0.328 . . . . 0.0 110.347 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.506 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 12.3 ptt180 -149.65 148.98 29.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.128 0.49 . . . . 0.0 112.101 -171.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.677 HG13 ' HB3' ' A' ' 60' ' ' TYR . 19.2 mt -119.79 121.55 66.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 173.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 87.5 m -112.62 126.32 55.24 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.265 0.555 . . . . 0.0 110.119 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.554 ' HG2' ' HA ' ' A' ' 39' ' ' MET . 0.0 OUTLIER -112.16 124.93 53.5 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.471 -173.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.516 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 18.4 tt -106.8 144.2 28.59 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.896 -178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HG13 ' A' ' 128' ' ' ILE . 7.9 Cg_endo -54.97 166.03 2.36 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.796 2.331 . . . . 0.0 112.503 172.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -64.53 89.97 0.09 OUTLIER Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.548 173.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.6 p -61.21 2.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.763 ' HB ' ' H ' ' A' ' 2' ' ' VAL . 15.1 t -75.18 -5.1 42.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.618 179.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.4 mp -85.26 -26.31 26.73 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.701 173.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -88.91 -50.32 6.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 138' ' ' LEU . . . -92.45 35.46 1.02 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.347 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.688 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -72.36 -67.99 0.51 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.443 -176.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.688 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 3.8 p30 -86.81 -22.57 25.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.516 ' HB3' ' HA ' ' A' ' 135' ' ' ALA . 5.4 tt -55.64 -55.72 28.84 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -75.0 -19.76 59.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.216 0.531 . . . . 0.0 109.964 -178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -68.87 -31.51 70.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.043 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 81.6 mm-40 -86.19 -38.63 17.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.621 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.105 -177.211 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.726 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 56.9 ttp . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 91.5 t -93.24 116.58 34.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 170.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.9 m -159.3 172.45 6.07 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -174.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 42.9 Cg_exo -57.85 152.24 51.43 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.845 1.697 . . . . 0.0 110.979 168.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 15.4 tt -74.61 -18.72 16.68 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.069 0.461 . . . . 0.0 111.681 -171.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -74.57 -32.19 62.31 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 34.9 m95 -72.67 128.19 34.82 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.489 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 2.0 tpp180 -84.1 121.1 26.97 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.446 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.62 138.76 31.22 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.113 0.482 . . . . 0.0 111.972 -175.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.452 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 84.5 t80 -131.53 102.44 5.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 174.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 58.78 -96.51 0.06 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.707 -174.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.726 ' HA ' ' HB2' ' A' ' 1' ' ' MET . 19.0 t -105.81 -12.08 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.691 -178.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -93.54 164.49 13.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.697 0.284 . . . . 0.0 111.356 -174.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 83.9 m -144.12 131.52 20.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.229 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.452 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 2.9 m-85 -123.5 134.77 53.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 -175.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.489 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 34.5 t80 -124.62 115.43 26.8 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 174.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -82.57 120.19 3.13 Favored 'Trans proline' 0 N--CA 1.458 -0.599 0 C-N-CA 123.13 2.553 . . . . 0.0 112.24 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.653 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -99.29 139.12 35.42 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.995 0.426 . . . . 0.0 110.228 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 5.0 p -94.43 -3.29 50.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.41 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -65.68 135.68 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.912 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.19 120.75 29.84 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.1 -178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.483 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 43.1 mmtm -144.25 150.97 38.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.363 177.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 119' ' ' ASN . 0.0 OUTLIER -68.96 158.94 33.69 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 167.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.417 ' HD1' ' CD1' ' A' ' 61' ' ' PHE . 82.5 t90 -52.48 -47.26 66.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.705 0.288 . . . . 0.0 111.358 -175.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.85 -45.14 93.97 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.274 -178.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.64 -27.13 63.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.955 0.407 . . . . 0.0 110.816 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.8 t -62.52 -43.95 97.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.18 175.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.562 ' OE2' HG11 ' A' ' 76' ' ' VAL . 8.7 tp10 -79.21 -21.39 46.35 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.311 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.32 -31.13 69.4 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.987 173.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.414 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.5 t-20 -85.41 -28.26 25.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.432 0.634 . . . . 0.0 109.742 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.459 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 80.9 m -84.61 -179.9 7.24 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.633 -0.876 . . . . 0.0 108.633 170.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 72.5 m 73.56 -45.79 0.62 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.755 0.422 . . . . 0.0 111.193 -175.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.08 -27.6 70.74 Favored Glycine 0 C--O 1.225 -0.454 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.66 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 75.3 mtm -92.74 7.37 43.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.806 0.336 . . . . 0.0 110.472 176.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.69 -6.28 70.47 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.367 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.779 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.79 -177.71 3.99 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.538 0.209 . . . . 0.0 111.318 -176.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 33.4 m-70 -148.53 169.76 19.57 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 122.773 0.429 . . . . 0.0 110.009 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.455 ' HB2' HG21 ' A' ' 76' ' ' VAL . 3.7 mm? -55.0 143.65 25.85 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.068 0.23 . . . . 0.0 110.496 173.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.3 tpt -49.6 109.6 0.29 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 123.654 0.596 . . . . 0.0 111.884 -177.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.65 HG22 ' HB3' ' A' ' 75' ' ' TRP . 27.3 p -107.92 106.76 17.17 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.326 177.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.9 mt -81.62 116.13 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.932 -176.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.3 p -102.89 -31.56 10.2 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.04 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.6 p -131.16 159.44 37.68 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.522 0.677 . . . . 0.0 111.904 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' HE ' ' A' ' 85' ' ' ARG . 19.8 mt-10 -68.42 -39.41 81.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.711 -177.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.26 -33.52 74.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.597 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 tt0 -58.84 -50.35 74.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.164 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.43 ' O ' HG23 ' A' ' 51' ' ' ILE . 34.3 tt0 -57.63 -55.44 34.76 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.761 177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 35.2 m-80 -59.17 -36.96 76.22 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.069 -175.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -69.49 -47.22 64.57 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 121.278 -0.169 . . . . 0.0 111.106 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.452 ' HA ' ' HD2' ' A' ' 53' ' ' PHE . 8.8 tp -70.59 -33.98 55.37 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 121.011 0.434 . . . . 0.0 111.58 -174.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.806 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.9 pt -71.06 -11.19 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.946 0.403 . . . . 0.0 110.938 -178.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.9 mt-30 -76.91 -27.55 54.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.634 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.452 ' HD2' ' HA ' ' A' ' 50' ' ' ILE . 55.1 m-85 -90.14 -21.77 22.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.596 -179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 83.2 mt -62.43 150.07 40.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.262 177.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -67.84 -13.48 62.17 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.701 -175.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 49.5 mtp180 66.84 30.55 7.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.911 0.386 . . . . 0.0 111.099 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.635 ' HB3' HD22 ' A' ' 58' ' ' LEU . 3.7 ttm180 -132.21 -56.36 0.97 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.832 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.635 HD22 ' HB3' ' A' ' 57' ' ' ARG . 2.7 mm? -83.27 170.96 14.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.453 -174.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.3 m -111.82 125.72 54.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.468 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.594 ' HB3' HG13 ' A' ' 125' ' ' ILE . 21.3 m-85 -108.76 126.52 53.11 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.56 0.207 . . . . 0.0 111.56 -171.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.44 ' HA ' HG12 ' A' ' 103' ' ' VAL . 13.7 m-85 -60.54 149.94 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.758 ' HB2' HG13 ' A' ' 102' ' ' VAL . 90.4 mt -120.91 -178.93 3.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.298 177.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.538 ' CA ' HG23 ' A' ' 76' ' ' VAL . . . -81.86 -17.94 68.97 Favored Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.749 -0.738 . . . . 0.0 114.193 -176.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.621 ' HB2' ' CG1' ' A' ' 102' ' ' VAL . 83.7 mt -71.78 121.53 19.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 117.666 0.733 . . . . 0.0 110.455 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.3 ptm85 -129.19 161.76 29.4 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.597 0.713 . . . . 0.0 112.32 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.672 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 1.8 t70 -135.61 151.52 50.34 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.676 177.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.986 ' HG2' ' HD2' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -112.07 -33.51 6.23 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 176.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -161.42 71.3 0.38 Allowed 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.688 -0.233 . . . . 0.0 111.251 -172.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.81 36.43 26.44 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.041 0.448 . . . . 0.0 111.449 174.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.986 ' HD2' ' HG2' ' A' ' 67' ' ' GLU . 32.3 mtpt -63.03 127.86 33.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.451 -177.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.65 -14.64 82.21 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.118 172.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.421 ' O ' ' HE2' ' A' ' 70' ' ' LYS . 4.1 pt20 -107.8 113.64 27.02 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.276 0.56 . . . . 0.0 110.251 178.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.548 ' HB3' HD22 ' A' ' 64' ' ' LEU . 44.9 m95 -99.33 158.65 15.56 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.779 -178.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.509 ' HG2' ' N ' ' A' ' 75' ' ' TRP . 3.6 ttt180 -152.04 149.38 28.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.537 176.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.65 ' HB3' HG22 ' A' ' 40' ' ' THR . 82.4 m95 -82.74 -174.65 5.35 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 123.568 0.542 . . . . 0.0 109.756 175.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.562 HG11 ' OE2' ' A' ' 28' ' ' GLU . 35.5 t -81.82 -65.09 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -174.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.89 -77.88 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.42 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -153.61 -18.07 0.14 Allowed 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.093 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.42 ' H ' ' H ' ' A' ' 78' ' ' GLN . 16.8 m -57.03 118.24 22.76 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.875 -176.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -71.33 169.71 20.12 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.042 2.495 . . . . 0.0 111.542 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.424 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 77.1 t80 -60.49 137.45 58.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.037 0.446 . . . . 0.0 110.001 177.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -97.24 118.86 64.14 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.784 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.51 -46.61 20.04 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.327 2.685 . . . . 0.0 113.879 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -85.5 -31.51 22.72 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.589 ' HD2' ' N ' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -92.08 80.03 5.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.286 0.565 . . . . 0.0 110.133 -176.256 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.0 t -128.61 103.87 10.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.507 -179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -127.35 67.51 1.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.338 -173.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.512 ' HA ' ' HB2' ' A' ' 113' ' ' TRP . 86.1 m95 -84.93 -166.41 1.48 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.855 0.359 . . . . 0.0 110.595 179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.616 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 69.1 m-70 -123.78 116.42 22.97 Favored 'General case' 0 CA--C 1.514 -0.404 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 174.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.454 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.8 tppt? -61.23 110.42 1.4 Allowed 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.145 0.974 . . . . 0.0 110.881 -177.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.403 ' N ' ' HD3' ' A' ' 90' ' ' LYS . 24.5 t-20 160.58 -51.99 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 112.507 -2.133 . . . . 0.0 107.393 -171.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.454 ' OE2' ' HA ' ' A' ' 90' ' ' LYS . 2.2 mp0 35.66 94.78 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.546 0 O-C-N 124.94 1.4 . . . . 0.0 111.77 -176.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -61.18 99.42 0.16 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.377 2.718 . . . . 0.0 114.04 -170.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -81.09 67.88 7.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.949 0.88 . . . . 0.0 108.856 173.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -122.46 -28.8 4.2 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.95 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.1 m -140.56 90.42 2.35 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.741 177.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.492 ' H ' ' CD ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -80.91 109.65 15.68 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.508 -179.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 127.18 143.28 5.75 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.109 -0.796 . . . . 0.0 111.109 -176.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 66' ' ' ASP . 19.0 mt-10 55.88 33.74 22.2 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -177.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 66' ' ' ASP . 0.9 OUTLIER -75.69 93.75 3.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.544 0.688 . . . . 0.0 110.717 -178.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.3 m -102.45 139.66 37.77 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.758 HG13 ' HB2' ' A' ' 62' ' ' LEU . 13.8 p -91.53 145.68 7.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -169.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.44 HG12 ' HA ' ' A' ' 61' ' ' PHE . 19.8 m -128.84 155.28 40.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.595 174.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.668 ' HG ' HD11 ' A' ' 62' ' ' LEU . 23.1 mt -88.35 118.92 28.3 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 171.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -130.37 141.62 45.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.42 178.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 26.8 t80 -75.64 108.37 8.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.703 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.426 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.9 t-20 -159.08 143.18 15.3 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 -177.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 66.73 35.33 5.19 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.314 0.578 . . . . 0.0 109.748 -173.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 70.69 4.11 4.85 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 114.548 -1.206 . . . . 0.0 112.691 174.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -145.5 175.44 10.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.882 0.372 . . . . 0.0 110.288 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.806 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 82.2 m95 -85.69 137.64 32.68 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 173.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.616 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -154.93 174.22 15.44 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.481 176.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.512 ' HB2' ' HA ' ' A' ' 88' ' ' TRP . 51.9 m0 -81.04 136.5 35.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.522 -172.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -129.93 130.07 44.64 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.112 175.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.82 123.92 27.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.193 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.24 158.63 63.72 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.761 -0.2 . . . . 0.0 110.529 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.43 135.89 67.51 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.332 2.021 . . . . 0.0 111.018 171.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.1 -27.39 66.43 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.762 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.445 ' HA ' HG22 ' A' ' 23' ' ' THR . 3.8 p30 -86.67 60.34 6.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.824 0.821 . . . . 0.0 110.639 175.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -137.25 116.78 12.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.118 -0.947 . . . . 0.0 110.059 177.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -63.1 117.98 7.25 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.071 0.462 . . . . 0.0 111.632 176.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.412 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -144.39 -176.39 5.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.575 . . . . 0.0 109.89 176.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 25.3 m -78.51 171.82 14.56 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.653 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -152.45 135.66 15.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -167.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.594 HG13 ' HB3' ' A' ' 60' ' ' TYR . 67.6 mt -105.85 127.45 60.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 172.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.9 t -107.74 121.95 45.75 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 73.4 tttt -112.28 129.2 56.36 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.897 -175.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.779 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.2 tt -129.87 141.13 40.78 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -70.9 166.8 27.84 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.087 1.858 . . . . 0.0 110.57 169.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.38 57.74 1.57 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.964 176.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 12.7 t -106.07 17.52 23.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.078 0.466 . . . . 0.0 110.98 -173.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 m -61.05 -20.08 62.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.148 0.499 . . . . 0.0 111.228 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.47 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.0 mp -79.84 -26.94 40.25 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.668 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -88.04 -37.54 16.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.221 0.534 . . . . 0.0 109.91 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.14 40.56 0.99 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.738 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.488 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -62.58 -57.36 11.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.986 -174.421 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.488 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 9.3 m-80 -74.26 -24.03 59.22 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.75 0.309 . . . . 0.0 110.625 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.97 -51.68 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 176.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -70.74 -23.52 62.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.394 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -70.88 -31.72 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.547 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -89.03 -6.37 57.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.456 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 37.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.833 -177.314 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.3 m -93.43 165.0 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 169.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HB2' HG21 ' A' ' 132' ' ' THR . 72.8 m -110.03 114.23 56.27 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-O 120.981 0.419 . . . . 0.0 112.052 -175.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.88 169.17 19.69 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.829 2.352 . . . . 0.0 110.915 171.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.5 pt -72.27 -18.51 19.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.903 0.382 . . . . 0.0 111.169 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.92 -49.49 70.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.985 177.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.506 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 25.2 m95 -62.05 139.24 58.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.889 178.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 14.1 mmm180 -84.71 129.51 34.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.864 0.364 . . . . 0.0 111.315 -176.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -102.37 121.46 42.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.933 -179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.48 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.4 t80 -121.41 105.16 10.25 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 69.55 -61.98 0.43 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 124.009 0.818 . . . . 0.0 110.956 -177.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.8 m -152.31 -25.83 0.17 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.795 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -82.9 156.46 23.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -175.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.623 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 23.5 m -120.05 137.71 53.95 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.134 -178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.48 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 16.7 m-85 -131.8 135.15 46.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.651 0.262 . . . . 0.0 110.72 -175.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.506 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 41.5 t80 -134.17 117.16 13.5 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.128 175.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -84.65 129.31 4.15 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.727 2.285 . . . . 0.0 112.258 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.8 mm? -104.75 139.35 39.68 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.835 176.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.5 p -105.53 3.31 29.26 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.214 -178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -88.08 137.2 32.54 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.658 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 94.5 m-20 -74.51 122.97 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.279 0.561 . . . . 0.0 111.587 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.596 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 43.7 mmtm -141.19 151.31 43.71 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.01 175.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 63.5 p -73.07 170.44 14.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 172.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.65 ' HZ3' ' HE ' ' A' ' 65' ' ' ARG . 20.8 t90 -62.6 -35.93 81.11 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.087 -0.645 . . . . 0.0 109.285 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.595 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -62.76 -51.62 66.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.55 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.596 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 11.0 mm-40 -61.53 -34.65 75.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.777 178.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.575 ' HB3' HD11 ' A' ' 38' ' ' LEU . 56.4 m -64.9 -45.07 87.46 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.367 177.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 17.2 pt-20 -73.74 -24.92 59.96 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.071 -0.251 . . . . 0.0 111.07 -177.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.5 mtm180 -78.63 -49.67 12.82 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.874 0.369 . . . . 0.0 111.166 177.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.32 -31.53 71.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' SER . 1.3 t -84.52 177.94 7.9 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 172.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 20.6 m 76.88 -46.54 0.51 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 122.506 0.322 . . . . 0.0 110.675 -176.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.63 -33.15 75.95 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 121.221 -0.514 . . . . 0.0 111.937 174.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 74.1 mtm -79.57 2.07 23.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.849 0.356 . . . . 0.0 110.745 176.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 74.13 47.85 17.03 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -173.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.658 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -148.54 -177.41 5.76 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -150.64 169.52 21.38 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 173.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.643 ' HB2' HG21 ' A' ' 76' ' ' VAL . 4.1 mm? -57.18 138.8 54.16 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 171.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.411 ' CE ' HG12 ' A' ' 41' ' ' ILE . 27.2 ttt -48.88 108.64 0.19 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.844 0.715 . . . . 0.0 112.325 -173.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -93.33 88.97 6.18 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.723 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.411 HG12 ' CE ' ' A' ' 39' ' ' MET . 48.2 mt -57.17 111.72 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.083 -176.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 10.1 m -93.0 -32.7 14.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.78 -176.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 2.9 t -138.75 153.85 48.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.0 112.128 -177.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.469 ' HG3' ' NH1' ' A' ' 85' ' ' ARG . 23.0 mt-10 -61.5 -35.26 77.19 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.79 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -63.58 -34.94 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.224 176.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.493 ' HB3' ' O ' ' A' ' 43' ' ' THR . 57.8 tt0 -61.0 -51.41 69.37 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.316 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' HA ' HG22 ' A' ' 50' ' ' ILE . 50.6 tt0 -62.51 -40.35 96.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.064 179.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -64.99 -27.86 69.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 20.8 m-85 -88.3 -34.28 17.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.608 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.2 tp -69.05 -33.39 58.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.861 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 37.5 pt -71.29 -4.45 4.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.86 0.362 . . . . 0.0 111.141 -178.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -84.93 -27.46 26.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.717 175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -89.91 -27.03 20.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.385 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.608 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.3 mt -74.89 129.45 37.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.168 -176.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.411 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.8 t70 -57.17 125.85 24.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.753 174.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.428 ' HG2' ' HE1' ' A' ' 111' ' ' TRP . 18.0 mtp180 -75.15 59.23 0.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.578 -176.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.532 ' HG2' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -161.9 -30.93 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.724 177.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.532 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mm? -84.26 172.62 11.68 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.384 0.611 . . . . 0.0 112.0 -178.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.5 m -122.38 122.73 39.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.26 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB3' HG13 ' A' ' 125' ' ' ILE . 70.6 m-85 -110.37 122.04 46.74 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -170.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.583 ' HA ' HG12 ' A' ' 103' ' ' VAL . 39.6 m-85 -60.49 130.54 47.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.964 0.411 . . . . 0.0 111.361 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.516 HD21 ' HB2' ' A' ' 104' ' ' LEU . 95.7 mt -99.95 174.37 6.22 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.197 178.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.495 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -82.75 47.95 3.9 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.322 -177.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -122.32 126.97 49.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.705 0.253 . . . . 0.0 110.359 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.65 ' HE ' ' HZ3' ' A' ' 24' ' ' TRP . 8.1 ttm180 -124.61 124.12 41.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 176.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.476 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 39.1 t0 -116.96 153.72 32.13 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 163.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.677 ' HB3' ' HZ3' ' A' ' 70' ' ' LYS . 27.9 tt0 -146.87 108.58 4.34 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.278 -168.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.66 HD22 ' HG2' ' A' ' 67' ' ' GLU . 48.8 m-80 68.53 23.83 7.21 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.744 0.653 . . . . 0.0 110.674 -179.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.476 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . . . 62.27 84.74 0.13 Allowed 'General case' 0 C--O 1.233 0.213 0 O-C-N 123.985 0.803 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HZ3' ' HB3' ' A' ' 67' ' ' GLU . 64.7 mttp -100.02 157.25 16.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.331 177.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -84.71 -12.34 75.13 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.591 -0.814 . . . . 0.0 111.094 176.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 72' ' ' GLN . 0.5 OUTLIER -123.8 102.34 7.75 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.338 0.589 . . . . 0.0 110.415 178.241 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 81' ' ' PHE . 11.7 m0 -78.51 167.91 20.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.272 178.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.612 ' NH2' ' HA ' ' A' ' 78' ' ' GLN . 43.8 ttt-85 -144.11 143.6 31.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.277 179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.495 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 67.7 m95 -78.75 167.17 21.59 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.643 HG21 ' HB2' ' A' ' 38' ' ' LEU . 69.4 t -60.06 -50.44 80.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.782 0.325 . . . . 0.0 110.999 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -96.94 77.79 2.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.964 0.411 . . . . 0.0 111.383 -174.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.612 ' HA ' ' NH2' ' A' ' 74' ' ' ARG . 44.5 tp60 69.36 -48.59 0.6 Allowed 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 169.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 24.1 m -48.69 126.74 13.48 Favored Pre-proline 0 C--N 1.325 -0.482 0 C-N-CA 122.861 0.464 . . . . 0.0 112.083 -173.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 5.2 Cg_exo -76.6 166.33 27.42 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.979 2.453 . . . . 0.0 111.776 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.563 ' HB2' ' HB2' ' A' ' 73' ' ' TRP . 84.1 t80 -53.82 132.79 42.16 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.14 0.495 . . . . 0.0 110.998 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -112.73 112.78 50.63 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.498 -175.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_exo -67.43 -16.17 47.05 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 123.181 2.587 . . . . 0.0 112.929 -179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.411 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.5 tpp180 -100.48 -20.42 15.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.999 0.428 . . . . 0.0 110.432 178.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.469 ' NH1' ' HG3' ' A' ' 44' ' ' GLU . 8.6 tpp180 -114.28 70.49 0.73 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.53 0.681 . . . . 0.0 110.11 178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.1 p -151.27 142.07 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.14 -0.936 . . . . 0.0 108.754 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -118.3 -37.88 3.27 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 111.882 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.462 ' O ' ' HB1' ' A' ' 112' ' ' ALA . 99.3 m95 59.11 -165.02 0.2 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.139 -174.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.562 ' HA ' ' HB1' ' A' ' 112' ' ' ALA . 12.0 t-80 -111.68 -61.52 1.69 Allowed 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.031 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.452 ' HE3' ' HB3' ' A' ' 90' ' ' LYS . 1.9 tmmt? 173.27 -36.63 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 124.007 0.817 . . . . 0.0 109.194 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -151.43 115.88 5.09 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.081 171.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.524 ' H ' ' CD ' ' A' ' 92' ' ' GLU . 3.3 pm0 -57.97 122.7 59.74 Favored Pre-proline 0 C--N 1.315 -0.932 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.651 173.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 9.9 Cg_endo -90.45 129.43 1.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.114 2.542 . . . . 0.0 112.643 -178.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -73.42 115.77 13.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.401 0.62 . . . . 0.0 110.357 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 175.6 -44.8 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.477 -1.238 . . . . 0.0 107.749 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.54 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 6.0 p -87.31 74.16 9.52 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.481 -1.236 . . . . 0.0 110.325 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -111.77 127.23 55.74 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.433 ' HA2' ' HA ' ' A' ' 68' ' ' ASN . . . 93.49 -55.36 2.37 Favored Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 110.469 -1.052 . . . . 0.0 110.469 -171.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.691 ' HB3' ' H ' ' A' ' 118' ' ' CYS . 40.0 mt-10 -114.09 104.2 11.89 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 171.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.54 ' HB3' ' O ' ' A' ' 96' ' ' SER . 2.1 p-10 -138.66 93.21 2.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 122.002 0.906 . . . . 0.0 110.873 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 97.5 m -110.28 121.99 46.6 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.878 177.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.408 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 35.3 m -74.4 136.49 25.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.311 0.577 . . . . 0.0 111.442 -176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.583 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.8 m -116.89 154.93 18.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.609 176.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.516 ' HB2' HD21 ' A' ' 62' ' ' LEU . 13.8 tp -83.59 100.86 11.08 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.1 p -120.18 143.05 33.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.433 0.635 . . . . 0.0 111.784 -171.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.405 ' CE1' ' HB3' ' A' ' 56' ' ' ARG . 65.5 t80 -83.61 97.03 8.85 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.573 -1.194 . . . . 0.0 109.76 176.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.522 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.1 t-20 -143.83 131.48 21.25 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 85.6 mt-30 66.62 29.34 8.9 Favored 'General case' 0 CA--C 1.52 -0.178 0 O-C-N 123.824 0.703 . . . . 0.0 109.302 -171.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 t70 72.82 -14.61 0.57 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.156 -1.384 . . . . 0.0 111.625 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -108.23 138.73 44.02 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.394 0.616 . . . . 0.0 111.245 -176.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.428 ' HE1' ' HG2' ' A' ' 56' ' ' ARG . 92.8 m95 -74.68 131.83 41.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.14 176.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.562 ' HB1' ' HA ' ' A' ' 89' ' ' HIS . . . -160.78 167.36 26.96 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.765 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 14.7 m0 -80.2 121.46 25.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.785 -177.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -123.83 130.89 53.34 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.531 178.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.09 125.02 25.77 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 29.8 m -137.2 159.49 69.51 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.201 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.6 134.99 47.95 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.054 1.836 . . . . 0.0 110.577 172.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.691 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 61.0 m -69.17 -35.43 76.29 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.805 0.336 . . . . 0.0 110.364 -175.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.519 ' HA ' ' HB ' ' A' ' 23' ' ' THR . 5.6 t30 -85.49 72.55 10.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.594 0.712 . . . . 0.0 109.412 170.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.54 ' O ' ' HA ' ' A' ' 23' ' ' THR . 84.9 t80 -137.85 131.59 31.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.95 -1.023 . . . . 0.0 108.798 176.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 21' ' ' ASN . 26.0 mp0 -75.28 110.15 9.38 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.979 0.419 . . . . 0.0 110.878 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.513 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -146.76 -177.25 5.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.199 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 16.1 m -79.37 173.98 12.03 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.729 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 13.4 ptt180 -154.65 158.84 40.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.818 0.342 . . . . 0.0 111.686 -171.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.598 HG13 ' HB3' ' A' ' 60' ' ' TYR . 49.3 mt -127.17 126.6 68.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.874 175.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 17.9 m -103.09 131.57 49.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 174.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -119.2 131.31 55.82 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.032 -176.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.623 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 81.1 mt -107.81 134.23 20.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.126 173.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -67.01 166.33 23.26 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.215 1.943 . . . . 0.0 111.344 177.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -72.09 54.61 1.44 Allowed Glycine 0 CA--C 1.519 0.291 0 C-N-CA 121.074 -0.584 . . . . 0.0 113.132 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 8.9 t -99.14 -19.06 17.37 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 122.816 -0.226 . . . . 0.0 110.897 -179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.456 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 4.4 t -65.93 -37.08 85.12 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 91.0 mt -58.83 -33.61 70.6 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.069 0.461 . . . . 0.0 111.27 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -81.61 -31.25 32.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.306 0.574 . . . . 0.0 109.678 177.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.51 7.8 37.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.052 -177.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 133' ' ' LEU . 50.6 mm-40 -62.88 -38.1 89.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.171 0.51 . . . . 0.0 110.104 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 8.7 t30 -69.44 -32.95 72.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.975 176.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.4 tt -66.28 -43.84 85.23 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -71.83 -20.75 61.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.532 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -68.93 -30.73 69.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.409 0.623 . . . . 0.0 109.635 173.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 14.3 mt-30 -86.53 -41.26 14.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.985 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.122 -0.942 . . . . 0.0 111.665 -177.88 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HA ' HG21 ' A' ' 132' ' ' THR . 4.2 ppp? . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.516 HG12 ' CG2' ' A' ' 132' ' ' THR . 3.2 p -154.56 124.48 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 121.381 0.61 . . . . 0.0 110.646 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.5 m -160.36 156.6 23.16 Favored Pre-proline 0 C--N 1.321 -0.638 0 N-CA-C 108.085 -1.079 . . . . 0.0 108.085 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -57.25 146.89 79.79 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.01 1.806 . . . . 0.0 110.994 173.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.6 mt -71.86 -27.8 28.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.195 0.521 . . . . 0.0 110.753 -174.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -71.61 -34.88 70.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.079 176.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -69.88 141.86 53.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.679 ' HD3' ' CE1' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -91.41 112.16 23.95 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.715 -174.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.79 133.53 35.12 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.022 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.486 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 79.1 t80 -138.68 102.57 4.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.977 178.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 63.74 -81.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.966 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.0 m -135.88 12.77 3.39 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.922 0.391 . . . . 0.0 110.986 -176.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -128.02 158.14 38.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.238 179.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 75.4 m -136.32 127.76 28.52 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.031 0.443 . . . . 0.0 110.093 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.486 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 13.2 m-85 -118.54 138.49 52.49 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.383 -173.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -118.63 112.81 36.79 Favored Pre-proline 0 C--N 1.318 -0.789 0 C-N-CA 120.582 -0.447 . . . . 0.0 109.884 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -89.8 121.56 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.197 2.598 . . . . 0.0 112.336 178.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.807 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 3.1 mm? -107.74 138.89 43.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.085 0.469 . . . . 0.0 110.884 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.2 p -90.87 -5.41 55.58 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.431 -0.804 . . . . 0.0 108.886 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.03 130.35 46.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.201 -1.363 . . . . 0.0 111.201 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -80.49 112.02 17.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.214 -175.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.654 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 39.2 mmtm -143.49 151.15 39.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.866 178.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 43.1 p -74.74 172.21 12.55 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 170.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 70.0 t90 -57.04 -41.53 78.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.091 0.472 . . . . 0.0 110.607 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -67.29 -45.19 77.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.397 -178.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 42.8 mt-10 -64.48 -36.63 84.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.46 -177.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -56.69 -44.71 81.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.761 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -79.53 -21.52 45.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.584 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 96.7 mtt180 -69.65 -40.15 76.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.895 0.379 . . . . 0.0 110.766 176.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -78.21 -31.23 49.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.346 0.593 . . . . 0.0 110.151 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 89.0 m -86.89 179.52 6.71 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.324 174.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 70.1 m 74.02 -40.15 0.45 Allowed 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.493 0.717 . . . . 0.0 110.472 -172.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.93 -27.94 73.6 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 170.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.9 mtm -92.88 7.04 45.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.825 0.345 . . . . 0.0 110.542 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.05 -14.64 48.22 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.664 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' CYS . . . -95.32 141.69 28.6 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.775 -0.25 . . . . 0.0 110.513 -177.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.555 ' CD2' HG13 ' A' ' 76' ' ' VAL . 19.9 t60 -118.31 150.52 39.35 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -177.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.3 mp -44.77 131.61 6.87 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.909 0.385 . . . . 0.0 111.929 -175.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.8 ttt -54.0 117.75 3.46 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.736 -169.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.575 HG21 ' OD1' ' A' ' 77' ' ' ASP . 19.2 p -104.79 97.07 7.01 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.22 174.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -66.09 113.17 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.408 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.4 m -94.66 -35.43 12.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.659 -176.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 1.8 t -131.31 151.52 51.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.667 0.746 . . . . 0.0 111.887 -177.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -59.83 -35.96 75.83 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.961 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.462 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.84 -41.06 97.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.997 0.427 . . . . 0.0 110.206 177.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.4 tt0 -55.02 -50.75 68.26 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.984 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.45 ' O ' HG23 ' A' ' 51' ' ' ILE . 51.9 tt0 -65.57 -49.24 69.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.843 178.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -59.33 -28.07 66.49 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -175.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.462 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 23.8 m-85 -85.97 -42.79 13.71 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.655 178.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.3 tp -68.17 -30.51 48.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.203 -175.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.642 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 38.0 pt -73.41 -2.64 3.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.106 0.479 . . . . 0.0 111.479 -177.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -87.62 -23.12 24.37 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.826 175.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.679 ' CE1' ' HD3' ' A' ' 8' ' ' ARG . 83.1 m-85 -95.78 -24.95 16.25 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.602 179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.0 mt -69.51 141.92 53.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.286 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 13.7 t70 -70.03 117.5 11.68 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.536 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 80.6 mtt180 -76.34 55.79 1.01 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.302 0.572 . . . . 0.0 111.405 -175.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 4.2 ttp180 -154.16 -32.68 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.423 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -93.22 152.78 18.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.054 0.454 . . . . 0.0 111.196 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 p -102.0 122.8 44.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.657 173.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.555 ' HB3' HG13 ' A' ' 125' ' ' ILE . 82.7 m-85 -102.25 127.57 49.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.369 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.557 ' HA ' HG12 ' A' ' 103' ' ' VAL . 26.6 m-85 -65.35 139.32 58.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.928 0.394 . . . . 0.0 111.577 175.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' A' ' 104' ' ' LEU . 86.2 mt -111.69 172.81 6.67 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.324 176.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -77.51 -5.36 85.86 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.776 -0.726 . . . . 0.0 113.535 -177.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.566 HD11 ' HB3' ' A' ' 73' ' ' TRP . 28.6 tp -73.68 115.65 13.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 117.266 0.533 . . . . 0.0 110.113 -178.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 67' ' ' GLU . 21.4 ttm180 -113.04 144.05 43.26 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.394 -172.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.494 ' N ' ' HG2' ' A' ' 65' ' ' ARG . 11.3 t0 -129.69 127.07 39.76 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 153.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB3' ' HD3' ' A' ' 65' ' ' ARG . 1.0 OUTLIER -105.89 14.38 28.12 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -172.211 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.544 ' HB3' ' HG2' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -163.95 17.25 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.93 178.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 54.33 40.13 31.49 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.502 0.668 . . . . 0.0 109.844 -174.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.653 ' HE2' ' HB2' ' A' ' 72' ' ' GLN . 14.2 mtmm -71.53 -24.9 62.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.736 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.26 6.7 70.86 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 -174.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.653 ' HB2' ' HE2' ' A' ' 70' ' ' LYS . 74.0 mt-30 -117.66 90.22 3.29 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.897 -0.652 . . . . 0.0 109.473 -178.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.566 ' HB3' HD11 ' A' ' 64' ' ' LEU . 98.6 m95 -72.26 129.92 39.57 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.167 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 62.8 mtm180 -132.48 142.7 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.437 ' CE3' HG22 ' A' ' 40' ' ' THR . 98.2 m95 -74.16 169.91 16.6 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.886 0.374 . . . . 0.0 110.452 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.555 HG13 ' CD2' ' A' ' 37' ' ' HIS . 12.7 p -78.78 -3.4 5.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.175 0.512 . . . . 0.0 111.723 -170.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.575 ' OD1' HG21 ' A' ' 40' ' ' THR . 3.4 p-10 -98.89 -80.79 0.46 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 175.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.473 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 0.9 OUTLIER -160.14 -23.77 0.06 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.006 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.6 m -54.53 130.49 63.17 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.805 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 2.9 Cg_exo -77.15 165.78 27.5 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 122.903 2.402 . . . . 0.0 111.536 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.582 ' HE1' ' HZ3' ' A' ' 113' ' ' TRP . 91.4 t80 -58.27 132.33 53.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.003 0.43 . . . . 0.0 110.692 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.547 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 0.8 OUTLIER -85.5 122.85 73.38 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.059 -176.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -60.99 -18.42 57.5 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.853 2.369 . . . . 0.0 113.359 -177.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 84' ' ' ARG . 38.6 mtt180 -113.34 16.96 18.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 111.35 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.547 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 19.8 mmt180 -120.57 80.24 1.59 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 171.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.5 t -126.81 105.04 13.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.032 -174.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.45 96.14 4.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.875 -177.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -121.21 -173.63 2.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.934 0.397 . . . . 0.0 110.625 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 95.4 m-70 -108.74 -166.25 1.1 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -179.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 91' ' ' ASN . 2.0 tmtp? -110.33 119.37 39.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.472 ' N ' ' HD3' ' A' ' 90' ' ' LYS . 17.7 t-20 61.45 76.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.532 0 O-C-N 124.191 0.932 . . . . 0.0 110.819 -179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -95.2 156.94 37.21 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.06 118.26 5.22 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.856 2.371 . . . . 0.0 113.286 -176.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -82.64 3.29 29.49 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.876 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -94.44 4.14 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -171.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.5 m -85.47 78.82 9.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.256 0.55 . . . . 0.0 110.24 178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -104.71 148.21 26.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.89 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 149.54 -108.77 0.41 Allowed Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 110.699 -0.96 . . . . 0.0 110.699 -178.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.789 ' HG2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -104.89 -44.31 4.86 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 172.13 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.9 t30 78.27 118.16 0.06 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.164 0.986 . . . . 0.0 113.477 169.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 69.7 m -127.46 152.98 46.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.236 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.614 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 27.5 m -98.36 140.62 17.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.236 0.541 . . . . 0.0 111.209 179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.557 HG12 ' HA ' ' A' ' 61' ' ' PHE . 33.2 m -122.96 153.1 27.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.725 174.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' A' ' 62' ' ' LEU . 15.0 mt -82.89 110.58 18.01 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 173.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.7 p -123.56 136.98 58.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.683 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 58.0 t80 -82.06 96.15 7.67 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.353 176.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 108' ' ' GLN . 27.0 t-20 -143.89 135.33 25.91 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 107' ' ' ASN . 52.4 mt-30 67.87 27.67 7.24 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 -173.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 59.55 17.79 6.43 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 114.295 -1.321 . . . . 0.0 112.699 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -130.8 136.23 48.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.004 0.43 . . . . 0.0 110.251 175.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.642 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 80.0 m95 -76.65 104.45 7.16 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.683 175.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.462 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -137.83 160.99 37.78 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.215 -178.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.614 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 25.0 m0 -72.91 149.45 43.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -176.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.495 HD22 HG13 ' A' ' 116' ' ' VAL . 4.8 t30 -137.37 131.19 31.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.364 175.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -68.35 123.74 21.58 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 123.655 0.597 . . . . 0.0 110.547 178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.495 HG13 HD22 ' A' ' 114' ' ' ASN . 18.6 m -146.52 151.66 43.77 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.586 177.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.69 135.53 62.45 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.201 1.934 . . . . 0.0 110.683 172.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.789 ' SG ' ' HG2' ' A' ' 99' ' ' GLU . 46.6 m -67.67 -20.6 65.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.916 0.389 . . . . 0.0 110.579 -176.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.439 ' C ' HD22 ' A' ' 119' ' ' ASN . 0.2 OUTLIER -91.43 66.72 5.52 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 121.464 0.65 . . . . 0.0 109.305 173.564 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -137.67 114.4 10.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.824 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.02 109.87 1.62 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.114 0.483 . . . . 0.0 110.826 -178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.462 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -143.54 -171.19 3.46 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.964 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 57.3 m -82.52 173.06 12.32 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 110.326 -0.25 . . . . 0.0 110.326 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.807 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -150.48 152.94 35.0 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -167.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.555 HG13 ' HB3' ' A' ' 60' ' ' TYR . 55.9 mt -136.97 131.41 46.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.96 177.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 90.2 m -120.24 143.89 48.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.184 0.516 . . . . 0.0 110.688 176.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -120.44 129.79 54.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.294 -0.867 . . . . 0.0 111.043 -172.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.6 tt -124.22 144.89 46.83 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 175.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.93 156.49 43.69 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 121.7 1.6 . . . . 0.0 110.48 169.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.441 ' C ' ' H ' ' A' ' 132' ' ' THR . . . -62.8 -11.09 35.03 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.003 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 58.5 p 62.96 -14.46 0.06 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.803 1.241 . . . . 0.0 113.501 176.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.654 ' HB ' ' HG2' ' A' ' 136' ' ' GLU . 23.1 p -79.16 -3.1 43.99 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.908 ' H ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -54.36 -33.64 59.51 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.303 172.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.652 ' H ' HD22 ' A' ' 133' ' ' LEU . 51.4 t-20 -90.89 -44.07 9.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.266 168.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.575 ' HB3' ' HA ' ' A' ' 132' ' ' THR . . . -86.24 0.83 52.86 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -164.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.654 ' HG2' ' HB ' ' A' ' 132' ' ' THR . 5.1 mm-40 -68.71 -44.63 73.49 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.503 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 44.2 t30 -71.48 -34.8 70.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.013 176.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.58 -46.45 89.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -66.01 -31.02 71.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.171 177.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -71.54 -42.54 67.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.212 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.503 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.5 mm-40 -78.05 -14.7 59.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.726 -175.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.396 -0.811 . . . . 0.0 110.346 -178.55 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.0 mtm . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 p -147.0 157.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.709 0.29 . . . . 0.0 110.992 -175.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.638 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 62.6 m -134.71 -178.8 0.93 Allowed Pre-proline 0 C--N 1.324 -0.515 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 177.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.638 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 81.7 Cg_exo -48.48 150.2 6.03 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 121.828 1.685 . . . . 0.0 111.655 170.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.07 -17.17 21.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -169.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -78.75 -33.0 46.91 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.069 0.461 . . . . 0.0 109.964 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.458 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 76.2 m95 -79.92 115.78 19.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 19.6 tpt180 -72.81 104.67 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.214 0.53 . . . . 0.0 110.358 -176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.2 133.27 42.72 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.198 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -134.73 102.24 5.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.411 177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.73 -82.89 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.554 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 56.6 m -133.49 2.38 3.5 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.821 0.344 . . . . 0.0 111.389 -177.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -117.79 162.9 17.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.8 m -137.98 133.43 33.66 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.807 0.337 . . . . 0.0 110.247 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -127.12 127.9 45.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.716 -174.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.506 ' CD2' HD22 ' A' ' 18' ' ' LEU . 49.2 t80 -104.11 113.23 65.46 Favored Pre-proline 0 C--N 1.322 -0.613 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 8.5 Cg_endo -89.96 119.41 0.81 Allowed 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 123.537 2.824 . . . . 0.0 111.597 174.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.506 HD22 ' CD2' ' A' ' 16' ' ' PHE . 1.1 pt? -135.31 140.57 45.22 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.448 0.642 . . . . 0.0 110.821 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 34.0 p -101.54 17.71 22.1 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.92 -172.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -73.23 141.37 47.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 18.5 m120 -67.8 118.7 11.39 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.571 -178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.89 ' HD3' ' HB3' ' A' ' 26' ' ' GLU . 2.3 mmpm? -159.89 146.91 16.38 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.582 0.753 . . . . 0.0 109.519 -178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.491 HG23 ' OE2' ' A' ' 121' ' ' GLU . 58.1 p -82.32 177.83 8.56 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.218 178.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.524 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 84.0 t90 -61.02 -45.68 93.81 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.91 82.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.595 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.89 ' HB3' ' HD3' ' A' ' 22' ' ' LYS . 21.9 mm-40 -63.6 -38.48 91.29 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.46 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.526 ' OG ' HD13 ' A' ' 38' ' ' LEU . 34.3 t -60.65 -48.66 80.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.803 0.335 . . . . 0.0 110.247 177.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -66.73 -27.02 67.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.67 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.8 ttp85 -82.83 -46.18 13.37 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.136 -174.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -69.84 -35.52 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.521 0.677 . . . . 0.0 109.959 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 32' ' ' SER . 69.1 m -87.97 179.5 6.42 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.204 171.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.832 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 63.4 m 78.98 -43.39 0.32 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 122.905 0.482 . . . . 0.0 110.62 -174.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.82 -14.49 63.13 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.782 172.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.5 mtm -98.61 11.61 37.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.586 0.231 . . . . 0.0 110.9 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 84.12 -2.24 87.9 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.926 -177.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.832 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -98.38 -173.88 2.68 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.683 0.393 . . . . 0.0 110.208 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CD2' HG13 ' A' ' 76' ' ' VAL . 4.5 t60 -149.19 155.32 40.46 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.526 HD13 ' OG ' ' A' ' 27' ' ' SER . 23.1 tp -56.37 131.51 48.47 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 125' ' ' ILE . 21.4 ttt -50.46 125.78 13.62 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -168.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 16.9 p -118.18 102.67 9.18 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.377 176.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.2 mt -73.29 112.67 9.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.646 -177.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 13.9 t -102.91 -29.68 11.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.513 -177.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 71.0 p -123.3 151.39 42.47 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.555 0.693 . . . . 0.0 112.049 -175.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -63.1 -40.2 96.94 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.102 179.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.403 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -62.41 -38.58 90.23 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.589 177.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 43' ' ' THR . 88.7 tt0 -54.85 -50.77 67.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.882 175.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.836 HE22 HD11 ' A' ' 104' ' ' LEU . 20.7 tp60 -59.16 -53.87 53.46 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.214 177.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.68 -36.94 80.0 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.257 -175.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.587 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 47.5 m-85 -88.33 -18.66 27.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -175.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.519 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 11.1 tp -82.49 -31.97 10.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.272 -0.571 . . . . 0.0 111.153 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.435 HG23 HE21 ' A' ' 47' ' ' GLN . 31.1 pt -67.9 -9.39 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -176.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 30.2 pt20 -86.44 -21.67 26.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.842 0.353 . . . . 0.0 110.561 177.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -89.72 -30.04 18.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.055 0.455 . . . . 0.0 109.934 178.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 52.6 mt -68.84 147.27 51.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.002 -178.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.466 ' HB3' HD23 ' A' ' 58' ' ' LEU . 14.7 t70 -85.09 131.77 34.41 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.401 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.7 mtt85 -78.03 14.47 1.13 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.314 -170.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 ttm-85 -105.86 -26.31 11.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.783 0.325 . . . . 0.0 110.726 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' A' ' 55' ' ' ASP . 3.1 mm? -98.51 175.24 6.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.519 0.676 . . . . 0.0 112.119 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 10.4 m -128.96 122.97 31.3 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.105 -0.952 . . . . 0.0 108.828 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -108.21 122.88 47.84 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 -172.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.453 ' CD2' ' HB3' ' A' ' 122' ' ' ALA . 6.6 m-85 -67.38 140.49 57.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.851 0.358 . . . . 0.0 111.196 176.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.81 HD11 ' HG ' ' A' ' 104' ' ' LEU . 93.4 mt -121.75 155.81 34.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.234 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -79.82 44.68 2.81 Favored Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.228 -0.51 . . . . 0.0 114.318 -172.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.495 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.7 tp -100.5 115.84 31.05 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 174.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -116.91 119.7 36.18 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -167.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -96.54 154.67 17.14 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 160.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.677 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.9 tt0 -137.74 86.63 2.2 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.026 -174.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.816 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 2.3 t-20 71.94 36.3 1.19 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.319 178.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 62.34 67.21 0.74 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.672 178.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 53.0 mttp -94.78 -23.04 17.69 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.774 178.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.26 -19.93 12.0 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.133 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.448 ' HG2' ' HB3' ' A' ' 70' ' ' LYS . 3.7 pt20 -83.86 92.98 7.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.319 0.58 . . . . 0.0 110.588 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.626 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 89.9 m95 -65.47 104.99 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.063 177.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -123.18 133.62 54.22 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.529 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 97.0 m95 -73.44 151.47 41.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 176.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.401 HG13 ' CD2' ' A' ' 37' ' ' HIS . 9.9 p -70.42 -5.84 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -172.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.3 p-10 -106.81 10.37 30.76 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 122.224 -0.297 . . . . 0.0 110.207 177.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 78' ' ' GLN . 5.2 tt0 81.04 6.36 1.33 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 124.275 0.984 . . . . 0.0 111.436 178.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.529 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 41.3 m -61.46 121.83 66.45 Favored Pre-proline 0 C--O 1.237 0.42 0 CA-C-O 121.008 0.432 . . . . 0.0 110.28 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -63.48 145.4 92.11 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 123.082 2.521 . . . . 0.0 112.544 179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.626 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 71.9 t80 -61.52 134.26 56.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.108 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.545 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -95.23 106.71 27.63 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.275 175.296 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 27.3 Cg_exo -62.96 -24.86 74.04 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.631 2.22 . . . . 0.0 112.486 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -99.21 3.68 46.45 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.325 -179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.545 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 76.2 mtt180 -134.82 30.26 3.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.853 0.359 . . . . 0.0 111.32 -177.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.481 ' HB ' ' CZ ' ' A' ' 81' ' ' PHE . 4.9 p -87.86 98.78 7.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.759 0.79 . . . . 0.0 109.552 174.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -84.38 74.14 10.39 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.481 -173.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 64.2 m95 -64.23 156.35 29.04 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 173.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.639 ' CD2' ' HB3' ' A' ' 112' ' ' ALA . 24.7 t-80 -67.93 -34.93 77.55 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.606 -173.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.507 ' HB3' ' OE1' ' A' ' 92' ' ' GLU . 7.8 ttpm? 176.55 -75.39 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 28.1 t-20 -135.68 -0.5 2.6 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.637 0.732 . . . . 0.0 109.423 177.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.507 ' OE1' ' HB3' ' A' ' 90' ' ' LYS . 1.9 mp0 -77.45 115.4 49.14 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.888 -174.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 2.2 Cg_endo -82.86 -11.18 10.23 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 123.022 2.482 . . . . 0.0 110.527 169.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 67.57 -161.0 0.22 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 114.411 -1.268 . . . . 0.0 111.53 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -114.55 6.01 15.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -169.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -88.74 162.35 16.29 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.476 0.655 . . . . 0.0 112.466 -172.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.422 ' O ' ' HB3' ' A' ' 100' ' ' ASN . 90.2 mt-30 -138.99 -157.32 0.76 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.276 -0.875 . . . . 0.0 108.763 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 99' ' ' GLU . . . -40.95 129.95 3.33 Favored Glycine 0 C--N 1.336 0.576 0 O-C-N 123.675 0.609 . . . . 0.0 113.894 -177.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.816 ' HG3' ' H ' ' A' ' 68' ' ' ASN . 25.3 mt-10 72.3 61.98 0.13 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 122.245 1.022 . . . . 0.0 109.587 -176.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.771 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.4 p-10 -117.69 154.66 31.29 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 113.954 -1.476 . . . . 0.0 110.643 -177.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 81.5 m -142.32 127.74 18.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.752 -173.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.657 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 16.8 m -78.9 146.67 7.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.014 0.435 . . . . 0.0 111.239 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.9 m -125.51 148.44 30.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.565 176.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.836 HD11 HE22 ' A' ' 47' ' ' GLN . 5.9 mt -83.88 106.13 15.32 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 2.4 p -128.54 139.61 51.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.847 -178.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -83.42 97.35 8.92 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.287 -0.87 . . . . 0.0 108.771 174.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -137.75 139.46 40.11 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.304 -0.862 . . . . 0.0 108.688 -174.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 58.23 49.84 10.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 -175.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 2.4 p30 53.05 18.91 1.23 Allowed 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.551 1.14 . . . . 0.0 113.394 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HB3' ' NZ ' ' A' ' 110' ' ' LYS . 0.1 OUTLIER -145.69 144.93 30.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.477 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.401 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.0 m95 -79.22 127.74 32.43 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.74 172.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.639 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -167.94 173.86 7.86 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 123.269 0.356 . . . . 0.0 110.259 174.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.657 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.4 m0 -84.17 119.02 24.52 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.998 0.428 . . . . 0.0 111.135 -176.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -105.76 132.39 51.94 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 166.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.771 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 8.4 t70 -85.99 123.79 31.71 Favored 'General case' 0 C--N 1.315 -0.922 0 C-N-CA 119.395 -0.922 . . . . 0.0 109.746 -175.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 42.1 t -132.31 140.61 38.5 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.404 -170.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -43.19 127.91 5.48 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.92 2.413 . . . . 0.0 111.668 174.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 5.8 m -69.65 -6.94 34.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.529 -172.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -96.61 9.64 40.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.875 178.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.433 ' O ' ' HA ' ' A' ' 23' ' ' THR . 80.9 t80 -86.31 132.21 34.03 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.038 176.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.491 ' OE2' HG23 ' A' ' 23' ' ' THR . 8.6 mm-40 -80.11 116.6 20.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.117 0.484 . . . . 0.0 110.284 175.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.453 ' HB3' ' CD2' ' A' ' 61' ' ' PHE . . . -142.79 -168.97 2.9 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.531 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.431 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 27.0 m -82.66 171.43 14.03 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -148.79 161.82 41.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -172.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.575 HG21 ' SD ' ' A' ' 39' ' ' MET . 4.4 mm -123.75 133.27 69.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.172 172.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 94.7 m -118.82 134.24 55.29 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.362 0.601 . . . . 0.0 110.328 174.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -112.18 135.95 52.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 -172.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 15.5 tt -139.06 142.45 33.27 Favored Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -64.52 166.96 16.09 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.306 2.004 . . . . 0.0 111.605 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.473 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -61.83 89.9 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.52 173.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 1.1 p -72.18 9.22 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.7 t -70.46 -15.32 62.8 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.82 -20.04 39.88 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.036 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -88.95 -46.99 8.46 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.228 178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -91.8 26.11 2.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.886 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -61.19 -48.93 79.25 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -174.713 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.409 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 19.2 t-20 -73.93 -30.28 62.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.94 0.4 . . . . 0.0 110.397 -178.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.88 -45.11 90.87 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -74.63 -21.54 59.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.734 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -70.85 -34.67 71.89 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.056 0.455 . . . . 0.0 110.241 178.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -86.7 -6.25 58.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.747 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.7 t . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.211 -175.842 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.618 ' HB2' HG21 ' A' ' 131' ' ' THR . 62.9 mtt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.9 m -142.78 138.56 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.152 0.282 . . . . 0.0 110.562 178.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.89 121.93 39.48 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.456 ' HB2' ' CD1' ' A' ' 7' ' ' TRP . 83.3 Cg_exo -48.37 143.98 14.24 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 123.063 2.509 . . . . 0.0 112.728 -177.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 27.9 pt -71.69 -11.56 15.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.34 -172.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -82.66 -18.95 39.24 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.598 ' HH2' ' HG3' ' A' ' 34' ' ' MET . 16.2 m0 -66.32 162.81 19.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.526 177.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.7 tpp180 -90.3 110.87 21.92 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.992 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.717 ' HB1' HD21 ' A' ' 133' ' ' LEU . . . -93.26 121.42 34.61 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.567 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 88.0 t80 -136.45 133.97 37.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.955 -177.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.442 ' HG3' ' CE2' ' A' ' 10' ' ' PHE . 48.1 mt-30 57.48 -94.77 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.365 0 O-C-N 123.688 0.618 . . . . 0.0 110.77 -174.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.0 p -141.03 27.72 1.95 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -131.57 160.41 35.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.715 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.61 ' HB2' HG23 ' A' ' 128' ' ' ILE . 7.8 m -117.59 127.36 53.89 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.567 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 22.4 m-85 -117.3 145.83 43.73 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.55 -174.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.503 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 5.8 t80 -136.41 115.2 10.68 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.305 176.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 4.8 Cg_endo -88.19 117.39 1.04 Allowed 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.385 2.723 . . . . 0.0 111.828 177.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.589 ' HG ' ' NH2' ' A' ' 124' ' ' ARG . 3.5 mm? -95.23 142.13 28.02 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.422 -178.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 p -110.58 4.51 20.37 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -81.67 168.51 18.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.354 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.441 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 3.1 p-10 -104.37 129.54 52.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.751 -179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.586 ' HE2' ' HB3' ' A' ' 26' ' ' GLU . 14.4 mmmm -156.17 141.32 17.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.633 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 34.6 p -57.35 160.98 3.61 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 173.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.537 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 52.9 t90 -56.6 -44.13 80.79 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -55.23 -47.38 75.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.408 177.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.586 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 38.5 mm-40 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.698 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 124' ' ' ARG . 49.5 m -59.25 -48.0 83.26 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.715 0.293 . . . . 0.0 110.66 173.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HA ' ' HB2' ' A' ' 38' ' ' LEU . 36.0 tt0 -56.83 -44.16 81.79 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.797 178.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 78.0 mtt180 -75.54 -35.11 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.595 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -72.14 -28.72 63.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.442 -170.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 32' ' ' SER . 18.6 m -97.97 127.03 43.66 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 166.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.613 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 58.3 p 166.13 -60.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.303 0.377 . . . . 0.0 110.448 -174.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.08 -25.38 59.69 Favored Glycine 0 C--N 1.331 0.283 0 CA-C-N 115.384 -0.826 . . . . 0.0 113.36 -176.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.598 ' HG3' ' HH2' ' A' ' 7' ' ' TRP . 0.9 OUTLIER -86.56 15.46 5.53 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.8 0.333 . . . . 0.0 110.591 178.409 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.22 23.3 63.57 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.613 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -124.62 -179.09 4.35 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.361 0.6 . . . . 0.0 111.822 -172.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -137.16 169.12 18.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.521 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 30.4 tp -60.96 128.38 36.2 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 168.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.658 ' HA ' ' HB3' ' A' ' 127' ' ' LYS . 24.6 ttt -47.35 112.26 0.51 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -167.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.3 p -93.0 110.54 22.01 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.242 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.564 HD13 ' CE ' ' A' ' 39' ' ' MET . 16.5 mm -55.12 106.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-O 121.333 0.587 . . . . 0.0 109.523 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 15.0 m -88.47 -38.37 15.06 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.627 -174.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 16.3 p -137.8 154.68 49.52 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.061 0.458 . . . . 0.0 110.866 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.93 -32.93 74.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.74 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.849 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -74.01 -34.69 64.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.729 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB3' ' O ' ' A' ' 43' ' ' THR . 37.0 tt0 -54.98 -50.16 69.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.109 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.743 HE21 HD21 ' A' ' 104' ' ' LEU . 40.4 tt0 -63.02 -47.32 83.56 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.736 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.849 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.8 p30 -68.43 -28.13 66.8 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.772 0.32 . . . . 0.0 111.356 -174.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -88.54 -17.78 29.52 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 177.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.436 HG22 ' HA ' ' A' ' 47' ' ' GLN . 10.2 tp -87.45 -28.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 118.679 0.672 . . . . 0.0 111.09 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.696 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.7 pt -69.9 -11.16 14.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -87.29 -18.32 30.44 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.734 0.302 . . . . 0.0 110.672 174.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -91.65 -22.09 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 109.658 177.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 90.8 mt -74.91 145.33 42.75 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.458 178.211 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.62 ' OD1' ' HB3' ' A' ' 57' ' ' ARG . 12.2 t70 -74.72 117.4 16.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 179.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.499 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 43.2 mtt180 -68.98 57.95 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.471 0.482 . . . . 0.0 111.759 -178.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' HB3' ' OD1' ' A' ' 55' ' ' ASP . 2.9 ttp180 -158.2 -33.5 0.07 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.832 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 55' ' ' ASP . 2.9 mm? -92.53 167.64 11.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.386 0.612 . . . . 0.0 111.672 -177.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.791 ' HB3' HG21 ' A' ' 103' ' ' VAL . 1.4 m -112.88 118.87 36.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.847 175.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.403 ' C ' HG23 ' A' ' 103' ' ' VAL . 92.4 m-85 -107.84 121.03 43.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.235 -173.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.536 ' CE2' ' HB3' ' A' ' 122' ' ' ALA . 26.7 m-85 -71.97 144.96 48.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.693 0.283 . . . . 0.0 111.149 177.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.651 HD13 HD23 ' A' ' 64' ' ' LEU . 0.7 OUTLIER -133.2 176.59 8.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.177 174.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.509 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -79.74 62.51 4.14 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 115.067 0.787 . . . . 0.0 115.067 -167.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.651 HD23 HD13 ' A' ' 62' ' ' LEU . 3.5 mm? -115.12 104.61 12.03 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 166.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.523 ' HB2' HG12 ' A' ' 76' ' ' VAL . 3.3 ttm-85 -93.82 116.91 29.41 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.197 0.522 . . . . 0.0 111.925 -169.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.701 ' HB3' ' HB2' ' A' ' 100' ' ' ASN . 0.3 OUTLIER -134.13 85.77 2.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.381 175.505 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -87.72 31.28 0.77 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.978 0.894 . . . . 0.0 108.817 176.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.47 ' HB3' ' NZ ' ' A' ' 70' ' ' LYS . 3.6 t-20 179.05 137.17 0.09 Allowed 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -168.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.474 ' HB2' ' H ' ' A' ' 98' ' ' GLY . . . -62.51 87.51 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 120.946 0.403 . . . . 0.0 110.152 170.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.592 ' HB2' ' HG2' ' A' ' 72' ' ' GLN . 2.2 ptpp? -126.33 118.91 26.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.821 -178.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -74.01 54.03 2.19 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.969 176.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.592 ' HG2' ' HB2' ' A' ' 70' ' ' LYS . 9.8 pt20 -154.26 44.68 0.55 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -178.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.684 ' CH2' ' HB3' ' A' ' 100' ' ' ASN . 77.4 m95 -37.11 117.0 0.49 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.5 1.125 . . . . 0.0 112.449 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -117.39 156.89 27.13 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.068 0.461 . . . . 0.0 111.097 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.509 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 42.1 m95 -86.84 153.37 21.7 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.674 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.523 HG12 ' HB2' ' A' ' 65' ' ' ARG . 34.7 m -73.33 -6.94 8.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -173.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -129.54 81.75 2.04 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.369 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.516 HE21 ' N ' ' A' ' 79' ' ' THR . 0.0 OUTLIER 68.29 -56.45 0.5 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.273 1.029 . . . . 0.0 113.117 175.077 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.516 ' N ' HE21 ' A' ' 78' ' ' GLN . 18.2 m -44.23 120.16 3.64 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 79' ' ' THR . 33.1 Cg_endo -66.91 169.64 14.42 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 123.361 2.708 . . . . 0.0 111.957 170.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -54.25 137.62 40.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.721 -177.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -91.09 108.23 26.75 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.08 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.84 -24.02 25.21 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.599 2.199 . . . . 0.0 113.071 -176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -95.4 -27.39 15.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.778 0.323 . . . . 0.0 111.361 -178.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 -112.4 83.72 1.85 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.167 0.508 . . . . 0.0 111.487 -173.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.9 t -124.22 100.92 8.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.14 175.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -98.28 92.34 5.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.677 -170.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -96.09 173.79 7.24 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 174.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.517 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 79.8 m-70 -83.62 -48.44 10.2 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.081 176.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -155.48 -41.03 0.08 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.968 171.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -171.37 65.5 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.514 ' OE1' ' HB2' ' A' ' 89' ' ' HIS . 22.9 mp0 -123.93 77.55 58.16 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.724 -178.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -94.94 -149.11 0.03 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.893 0 C-N-CA 123.106 2.537 . . . . 0.0 111.877 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.41 120.91 3.09 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.763 0.664 . . . . 0.0 110.552 174.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.439 ' HB3' ' CG ' ' A' ' 115' ' ' ASP . 3.3 t30 -133.81 -50.04 0.83 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.521 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.6 t -80.9 82.45 6.88 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.069 0.461 . . . . 0.0 109.939 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -61.86 102.12 0.25 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.96 0.886 . . . . 0.0 111.963 -174.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.474 ' H ' ' HB2' ' A' ' 69' ' ' ALA . . . 154.54 -59.42 0.39 Allowed Glycine 0 C--N 1.314 -0.683 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.59 ' OE2' ' HB2' ' A' ' 118' ' ' CYS . 41.6 mt-10 -105.12 -148.81 0.41 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 166.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.701 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 5.1 m-20 -165.64 -91.85 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 169.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.709 ' HB2' ' O ' ' A' ' 116' ' ' VAL . 2.3 m 66.8 116.46 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 O-C-N 124.01 0.819 . . . . 0.0 111.6 168.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.63 HG13 ' CH2' ' A' ' 73' ' ' TRP . 4.7 m -107.16 144.98 15.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.645 0.736 . . . . 0.0 112.694 -178.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.791 HG21 ' HB3' ' A' ' 59' ' ' SER . 2.2 p -111.43 148.79 14.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 114.509 -1.223 . . . . 0.0 110.394 175.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.743 HD21 HE21 ' A' ' 47' ' ' GLN . 12.0 mt -82.29 101.65 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 164.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.21 150.21 25.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.474 -175.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -81.35 115.16 20.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.061 -177.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 40.2 t30 -162.1 129.85 3.99 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 176.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.429 ' C ' ' H ' ' A' ' 110' ' ' LYS . 18.3 mt-30 69.09 35.9 2.61 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 -173.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 18.5 t70 71.31 -25.46 0.17 Allowed 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 114.407 -1.269 . . . . 0.0 111.802 -178.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' A' ' 108' ' ' GLN . 21.3 pttm -101.2 146.75 27.1 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.504 0.669 . . . . 0.0 111.15 -173.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.696 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 69.3 m95 -81.91 130.86 35.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.423 172.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -156.17 167.17 31.26 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.567 ' HA ' ' O ' ' A' ' 103' ' ' VAL . 42.0 m0 -71.74 143.59 49.56 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 123.667 0.605 . . . . 0.0 110.78 -176.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 3.9 t30 -140.52 147.47 39.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.39 174.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.439 ' CG ' ' HB3' ' A' ' 95' ' ' ASN . 5.3 t70 -66.92 124.64 23.56 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.387 0.429 . . . . 0.0 111.039 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.709 ' O ' ' HB2' ' A' ' 101' ' ' CYS . 3.5 m -154.89 116.46 2.42 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.694 175.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.17 147.59 8.1 Favored 'Trans proline' 0 CA--C 1.529 0.241 0 C-N-CA 122.8 2.333 . . . . 0.0 112.777 -175.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.596 ' O ' ' HB ' ' A' ' 23' ' ' THR . 33.5 m -70.22 -11.52 60.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.65 0.262 . . . . 0.0 111.023 -177.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -89.97 6.61 41.4 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.633 ' O ' ' HA ' ' A' ' 23' ' ' THR . 79.0 t80 -93.99 133.26 37.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 176.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.487 ' OE2' HG23 ' A' ' 23' ' ' THR . 7.8 mm-40 -83.67 134.24 34.78 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.047 178.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.536 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -159.47 -170.2 2.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.351 174.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.484 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 30.0 m -81.0 164.82 22.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.793 -177.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.589 ' NH2' ' HG ' ' A' ' 18' ' ' LEU . 42.1 mtm105 -127.86 161.72 28.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.137 0.494 . . . . 0.0 111.913 -170.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 19.5 mt -134.3 125.25 47.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 57.7 m -102.66 129.69 49.33 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.658 ' HB3' ' HA ' ' A' ' 39' ' ' MET . 1.1 tppp? -114.85 122.55 46.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.007 0.432 . . . . 0.0 110.838 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 14' ' ' CYS . 8.3 tt -129.34 140.94 40.12 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.024 174.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.462 ' HD2' HG13 ' A' ' 128' ' ' ILE . 19.7 Cg_endo -59.16 153.26 53.79 Favored 'Trans proline' 0 C--O 1.233 0.255 0 C-N-CA 122.265 1.976 . . . . 0.0 111.914 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -74.35 57.81 2.41 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.073 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.618 HG21 ' HB2' ' A' ' 1' ' ' MET . 2.9 t -60.3 -35.32 75.31 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 122.736 0.415 . . . . 0.0 111.132 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.4 p -94.85 2.16 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.957 0.408 . . . . 0.0 111.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.717 HD21 ' HB1' ' A' ' 9' ' ' ALA . 10.5 mp -90.16 -31.38 17.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 173.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -87.29 -55.63 3.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.178 175.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' ' 139' ' ' TYR . . . -90.14 40.06 0.99 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.436 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.61 -50.2 72.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -175.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -80.1 -31.15 39.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.226 0.536 . . . . 0.0 110.285 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.41 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 2.3 tm? -61.24 -44.41 97.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.281 177.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 135' ' ' ALA . 0.2 OUTLIER -76.09 -25.09 55.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.989 178.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -67.47 -31.2 71.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.746 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -86.92 -5.43 59.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.539 178.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.386 -0.816 . . . . 0.0 111.123 -177.263 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.439 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.485 1.279 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.442 ' O ' ' HD3' ' A' ' 4' ' ' PRO . 18.9 m -138.14 162.89 30.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 173.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.483 ' SG ' ' HA2' ' A' ' 130' ' ' GLY . 13.3 m -113.88 93.06 27.65 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-O 121.01 0.433 . . . . 0.0 110.216 -179.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.519 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 4.6 Cg_endo -86.51 163.02 9.53 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.554 2.836 . . . . 0.0 113.881 -176.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.1 mt 56.88 -98.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.572 171.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -118.93 15.46 13.38 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -172.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.537 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 79.0 m95 -68.63 105.09 2.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 172.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 30.3 mmt180 -73.35 114.46 11.59 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.896 -173.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -85.76 121.73 28.84 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.766 178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.465 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 87.5 t80 -129.93 102.67 6.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.878 178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 66.76 -70.7 0.1 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.568 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -142.35 -11.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.119 -179.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -100.33 159.06 15.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.9 0.381 . . . . 0.0 111.487 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 73.4 m -133.69 127.95 33.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.668 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.466 ' OH ' ' HG3' ' A' ' 46' ' ' GLU . 13.2 m-85 -121.37 137.75 54.56 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.738 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.537 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 33.4 t80 -124.26 114.93 27.46 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.711 0.291 . . . . 0.0 110.357 176.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 19.2 Cg_endo -89.53 128.13 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 123.346 2.698 . . . . 0.0 112.429 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.572 HD22 ' NH2' ' A' ' 124' ' ' ARG . 4.1 mp -119.36 139.18 52.4 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 41.5 p -107.76 19.97 19.42 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.169 -175.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -93.17 138.31 31.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.92 0.39 . . . . 0.0 110.867 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -56.38 115.56 2.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.719 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.491 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 0.3 OUTLIER -156.11 141.1 17.27 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 120.904 0.383 . . . . 0.0 110.896 -174.142 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' HG3' ' A' ' 26' ' ' GLU . 77.7 p -81.65 158.46 24.29 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 54.6 t90 -57.17 -45.05 84.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.917 0.389 . . . . 0.0 110.634 -177.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.04 -44.17 91.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.177 -178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.545 ' HG2' ' NH1' ' A' ' 29' ' ' ARG . 47.3 mt-10 -72.46 -35.41 68.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.221 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.591 ' HB3' ' HD3' ' A' ' 124' ' ' ARG . 67.3 m -52.3 -51.28 59.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.03 175.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.428 ' CD ' ' HD1' ' A' ' 37' ' ' HIS . 9.8 tp10 -76.69 -21.08 55.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.605 -178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.545 ' NH1' ' HG2' ' A' ' 26' ' ' GLU . 53.1 ttp180 -68.4 -37.41 80.33 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.079 0.466 . . . . 0.0 110.762 175.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -81.15 -37.27 29.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.519 0.676 . . . . 0.0 110.035 178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 32' ' ' SER . 86.6 m -85.47 179.91 7.05 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.631 175.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.688 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 27.6 t 79.62 -43.65 0.29 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 122.715 0.406 . . . . 0.0 110.643 -177.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.94 -20.07 64.11 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.325 175.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.3 mtm -92.15 9.22 34.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 0.0 110.343 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.13 51.03 7.11 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -172.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.688 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -144.56 -178.35 5.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.936 0.398 . . . . 0.0 111.446 -170.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.428 ' HD1' ' CD ' ' A' ' 28' ' ' GLU . 2.9 m-70 -159.46 166.84 30.1 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 169.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 10.5 mp -65.92 158.4 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.589 174.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.408 ' SD ' ' HD1' ' A' ' 15' ' ' TYR . 65.3 mmm -46.51 104.19 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -174.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.474 ' HA ' ' CZ3' ' A' ' 75' ' ' TRP . 18.9 p -98.72 93.28 6.0 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.498 0.665 . . . . 0.0 109.388 169.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.5 mt -76.01 122.47 30.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.158 -173.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 12.0 m -107.86 -27.29 10.31 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.874 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.1 p -134.53 155.74 49.87 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.619 0.723 . . . . 0.0 112.241 -176.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -65.67 -37.96 87.96 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.623 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.702 ' HA ' ' ND2' ' A' ' 48' ' ' ASN . . . -69.33 -37.85 77.91 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.466 ' HG3' ' OH ' ' A' ' 15' ' ' TYR . 67.1 tt0 -53.72 -50.62 65.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.584 0.707 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.457 ' NE2' HD13 ' A' ' 51' ' ' ILE . 1.0 OUTLIER -64.14 -48.67 75.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.801 -1.09 . . . . 0.0 111.008 179.299 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.702 ' ND2' ' HA ' ' A' ' 45' ' ' ALA . 1.0 OUTLIER -68.12 -27.27 66.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.28 -0.418 . . . . 0.0 112.025 -175.529 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.611 ' O ' ' HG2' ' A' ' 52' ' ' GLN . 3.2 m-85 -80.6 -32.48 36.41 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 178.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.56 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 8.9 tp -78.51 -30.47 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.321 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.527 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 40.9 pt -71.17 -9.69 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -175.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 11.1 pt20 -87.48 -13.44 43.14 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.382 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -94.63 -23.6 17.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.2 0.524 . . . . 0.0 109.639 174.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 75.9 mt -74.31 150.17 40.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.594 -179.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' A' ' 57' ' ' ARG . 45.1 t0 -80.43 127.43 32.4 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.641 178.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.582 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 75.1 mtt180 -80.28 30.17 0.28 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 -167.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.57 ' HG2' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -139.38 -1.2 1.72 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.779 169.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.57 HD13 ' HG2' ' A' ' 57' ' ' ARG . 2.7 mp -100.74 157.7 16.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.13 0.49 . . . . 0.0 111.397 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.72 ' HB3' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -109.81 117.3 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.427 179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' HB3' HG13 ' A' ' 125' ' ' ILE . 83.6 m-85 -108.77 121.46 45.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.522 0.201 . . . . 0.0 111.201 -176.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -64.99 141.82 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.186 0.517 . . . . 0.0 112.103 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.648 HD11 ' HG ' ' A' ' 104' ' ' LEU . 65.0 mt -107.06 158.73 16.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.152 175.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -81.58 49.98 4.15 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.217 -174.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.618 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 40.2 tp -131.59 124.07 29.24 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 4.8 ptm85 -133.99 154.37 51.16 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.748 0.785 . . . . 0.0 112.493 -174.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -112.17 152.52 28.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.216 -1.356 . . . . 0.0 107.359 166.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.591 ' HB3' ' HD2' ' A' ' 70' ' ' LYS . 4.2 tp10 -109.41 104.56 13.67 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.881 -172.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 11.2 m120 72.26 -66.74 0.29 Allowed 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.745 0.653 . . . . 0.0 110.798 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -179.82 80.26 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 123.75 0.82 . . . . 0.0 108.828 179.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.612 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 17.1 mtpp -101.51 -61.6 1.36 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.329 -174.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 115.53 -21.84 12.44 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.612 ' OE1' ' HB3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -113.96 107.23 15.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.687 0.756 . . . . 0.0 110.309 177.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.618 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 25.7 m95 -76.15 150.9 37.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.898 -1.047 . . . . 0.0 110.951 -177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.16 143.52 46.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 176.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.474 ' CZ3' ' HA ' ' A' ' 40' ' ' THR . 98.7 m95 -74.98 161.72 29.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.7 p -75.96 -6.57 8.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.384 0.611 . . . . 0.0 111.396 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.457 ' O ' ' HB3' ' A' ' 78' ' ' GLN . 15.4 p30 -109.0 21.24 17.46 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.284 175.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 77' ' ' ASP . 57.8 tp60 79.29 -8.18 1.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.146 174.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 36.1 m -58.84 124.34 72.87 Favored Pre-proline 0 C--N 1.323 -0.569 0 O-C-N 122.06 -0.4 . . . . 0.0 110.525 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 32.2 Cg_exo -62.54 149.57 90.58 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.534 2.156 . . . . 0.0 111.763 175.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.447 ' O ' ' HD3' ' A' ' 83' ' ' PRO . 76.2 t80 -59.92 122.63 14.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.119 0.485 . . . . 0.0 111.756 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.474 ' ND2' ' HB3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER -82.19 106.76 7.0 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.49 174.349 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.447 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 23.6 Cg_exo -63.7 -53.27 1.39 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.085 2.523 . . . . 0.0 112.484 -176.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 -89.83 34.41 0.84 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.975 0.416 . . . . 0.0 111.305 -177.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.474 ' HB3' ' ND2' ' A' ' 82' ' ' ASN . 12.2 tpt180 -140.43 21.73 2.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.215 0.531 . . . . 0.0 109.623 176.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.537 HG23 ' CE3' ' A' ' 113' ' ' TRP . 11.0 p -107.04 148.8 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.11 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -129.0 74.74 1.6 Allowed 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.25 -0.18 . . . . 0.0 110.692 -177.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -69.69 174.25 5.29 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.023 0.439 . . . . 0.0 111.102 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.643 ' CE1' ' HB2' ' A' ' 107' ' ' ASN . 54.5 m-70 -83.8 -60.99 1.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.688 0.28 . . . . 0.0 110.854 -178.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -131.07 -68.74 0.66 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.752 0.786 . . . . 0.0 109.707 -175.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.4 p30 179.65 52.49 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 113.908 -1.496 . . . . 0.0 107.395 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 93' ' ' PRO . 1.2 mp0 -46.85 114.15 2.68 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 114.119 -1.4 . . . . 0.0 111.85 -172.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 92' ' ' GLU . 2.9 Cg_exo -76.26 177.91 8.17 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 123.496 2.797 . . . . 0.0 112.942 -175.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -73.37 90.45 1.67 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.405 178.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -111.31 -39.62 4.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.156 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.542 ' HB2' ' ND2' ' A' ' 100' ' ' ASN . 4.2 m -85.27 117.49 24.24 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.918 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -123.74 88.04 2.84 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 146.53 89.69 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.496 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 10.1 pt-20 43.17 92.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.409 1.084 . . . . 0.0 111.837 -174.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.542 ' ND2' ' HB2' ' A' ' 96' ' ' SER . 2.1 m-20 -86.02 139.48 31.13 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.312 -177.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 56.2 m -136.15 143.27 44.4 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.941 0.401 . . . . 0.0 109.981 176.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.551 HG13 ' HB2' ' A' ' 62' ' ' LEU . 12.1 p -95.04 145.06 8.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.256 0.55 . . . . 0.0 111.841 -171.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.72 HG21 ' HB3' ' A' ' 59' ' ' SER . 1.0 OUTLIER -126.95 142.5 43.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.353 -179.553 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.648 ' HG ' HD11 ' A' ' 62' ' ' LEU . 11.3 mt -83.64 109.44 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 167.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p -132.43 148.28 31.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.609 -176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.582 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 10.2 t80 -87.75 96.09 10.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.095 -178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.643 ' HB2' ' CE1' ' A' ' 89' ' ' HIS . 14.2 m120 -131.48 144.04 50.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 65.89 24.73 11.23 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.62 0.575 . . . . 0.0 109.634 -176.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 64.64 22.94 12.73 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.833 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -137.08 148.3 46.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.025 0.44 . . . . 0.0 110.65 176.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.527 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 81.5 m95 -79.66 124.38 28.5 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.493 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -158.27 167.19 30.45 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.898 0.38 . . . . 0.0 111.096 178.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.537 ' CE3' HG23 ' A' ' 86' ' ' VAL . 7.6 m0 -78.55 138.75 38.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.969 -176.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -134.64 144.82 48.08 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 178.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -86.27 124.86 33.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.866 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 25.6 m -141.26 158.78 63.32 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.41 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.516 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 14.2 Cg_endo -58.1 133.17 53.72 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.406 2.071 . . . . 0.0 111.011 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 99' ' ' GLU . 3.8 t -72.52 -16.99 61.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.992 0.425 . . . . 0.0 111.245 -173.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -89.95 4.6 49.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.009 0.433 . . . . 0.0 110.185 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.516 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 63.3 t80 -81.2 151.01 28.39 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 175.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -102.93 142.34 34.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.23 0.538 . . . . 0.0 110.995 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.91 -167.62 1.56 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.26 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 26.4 m -78.91 170.99 15.82 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.141 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.591 ' HD3' ' HB3' ' A' ' 27' ' ' SER . 4.2 ttp180 -144.84 145.57 31.68 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -168.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.668 HG13 ' HB3' ' A' ' 60' ' ' TYR . 9.6 mt -128.4 125.29 63.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 89.8 m -113.04 146.58 38.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.037 0.446 . . . . 0.0 110.512 177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -121.12 132.92 55.15 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.304 -170.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.514 ' CG1' ' HB2' ' A' ' 36' ' ' ALA . 29.3 mt -128.59 141.06 40.27 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.979 176.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.582 ' HB2' HG23 ' A' ' 131' ' ' THR . 13.4 Cg_exo -65.87 133.59 34.29 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.325 1.35 . . . . 0.0 110.251 169.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.483 ' HA2' ' SG ' ' A' ' 3' ' ' CYS . . . -48.24 -55.93 9.84 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 121.224 -0.512 . . . . 0.0 112.105 -177.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.582 HG23 ' HB2' ' A' ' 129' ' ' PRO . 48.0 p 61.93 -31.76 0.08 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.078 1.351 . . . . 0.0 113.849 176.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 130' ' ' GLY . 10.3 t -63.12 -21.83 66.45 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 122.462 0.305 . . . . 0.0 111.045 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.585 ' H ' HD22 ' A' ' 133' ' ' LEU . 2.8 mm? -56.37 -21.23 23.44 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.627 -178.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -87.39 -41.68 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.101 0.477 . . . . 0.0 110.195 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.79 16.95 8.32 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.271 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -55.49 -52.43 63.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.002 0.429 . . . . 0.0 111.246 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -73.77 -27.66 61.27 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.476 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -63.2 -47.99 80.22 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 177.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.645 ' HA ' ' OG ' ' A' ' 142' ' ' SER . 53.2 t80 -75.12 -24.31 58.02 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.332 179.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -65.79 -26.56 67.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.347 0.594 . . . . 0.0 109.979 174.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -83.71 -32.79 25.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.423 175.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . 0.645 ' OG ' ' HA ' ' A' ' 139' ' ' TYR . 96.7 p . . . . . 0 C--O 1.252 1.23 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.577 -170.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.72 ' HG3' ' HA ' ' A' ' 12' ' ' SER . 77.2 mtm . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.418 ' H ' ' HB3' ' A' ' 1' ' ' MET . 7.4 p -69.57 119.57 15.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.238 0.542 . . . . 0.0 110.433 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 76.2 m -147.16 171.04 6.81 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.557 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 66.2 Cg_exo -53.07 154.15 14.24 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.356 2.037 . . . . 0.0 112.417 176.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.6 tp -70.47 -17.39 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.092 -171.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -83.16 -23.85 32.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.863 0.363 . . . . 0.0 110.841 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.557 ' HD1' ' HB2' ' A' ' 4' ' ' PRO . 37.2 m95 -82.1 154.86 25.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.027 0.442 . . . . 0.0 110.258 178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 34.9 mmt-85 -108.61 118.13 35.97 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.119 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.46 133.05 35.3 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.974 -174.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.482 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 78.1 t80 -129.15 102.24 6.38 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 174.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 58.31 -97.35 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.777 -176.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.72 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 9.9 p -93.63 -38.43 11.35 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.92 -178.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -82.56 168.45 17.35 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.362 0.601 . . . . 0.0 112.537 -172.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 72.0 m -146.71 129.46 16.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.579 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.511 ' CE2' ' HE3' ' A' ' 127' ' ' LYS . 5.0 m-85 -120.93 141.91 50.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.578 0.228 . . . . 0.0 110.994 -173.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.42 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 47.4 t80 -128.69 118.23 19.85 Favored Pre-proline 0 C--N 1.319 -0.722 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.018 176.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -84.69 120.16 2.34 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.672 2.248 . . . . 0.0 112.07 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.635 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 4.1 mp -109.08 139.83 43.44 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.996 0.427 . . . . 0.0 110.188 -179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.9 p -106.3 13.37 28.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.479 -177.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.547 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 12.4 p-10 -79.35 126.24 30.55 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.57 ' HB2' ' HB3' ' A' ' 121' ' ' GLU . 5.4 p-10 -70.59 104.45 2.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.73 0.776 . . . . 0.0 110.692 -177.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 22' ' ' LYS . 64.3 mmtt -135.71 156.71 48.4 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.217 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.0 p -77.67 171.55 14.77 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.371 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -60.07 -40.25 88.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.194 0.521 . . . . 0.0 109.996 178.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.7 -48.77 75.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.244 -179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.667 ' HG2' HH11 ' A' ' 29' ' ' ARG . 19.7 mt-10 -68.2 -34.97 77.25 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.283 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.443 ' HB3' HD11 ' A' ' 38' ' ' LEU . 67.9 m -53.17 -50.46 64.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.008 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HG2' HD13 ' A' ' 38' ' ' LEU . 9.5 mm-40 -72.1 -22.23 61.38 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.724 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.667 HH11 ' HG2' ' A' ' 26' ' ' GLU . 51.1 mtp180 -69.03 -35.53 76.74 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.767 0.318 . . . . 0.0 111.273 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -80.51 -28.52 37.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.556 0.693 . . . . 0.0 109.747 176.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 93.4 m -85.42 178.61 7.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.473 173.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 t 74.96 -50.65 0.67 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.819 0.447 . . . . 0.0 110.954 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.15 -25.12 69.37 Favored Glycine 0 C--O 1.227 -0.293 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.151 178.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.3 mtm -91.89 6.08 47.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.579 0.228 . . . . 0.0 110.619 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.33 -1.18 87.98 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.64 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.614 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.82 -176.75 3.67 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.478 -0.361 . . . . 0.0 110.708 -178.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.17 163.1 40.01 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 176.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.506 HD13 ' HG2' ' A' ' 28' ' ' GLU . 5.2 mp -56.16 144.66 28.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.04 0.448 . . . . 0.0 111.528 177.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.441 ' HA ' ' HD2' ' A' ' 127' ' ' LYS . 14.2 tpt -53.43 113.37 1.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.246 -0.888 . . . . 0.0 112.656 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.429 ' H ' ' CD ' ' A' ' 127' ' ' LYS . 38.6 p -104.62 135.95 45.07 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.059 171.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.8 mt -105.61 116.79 50.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.159 0.504 . . . . 0.0 110.716 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 54.3 p -97.63 -40.58 8.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.233 -178.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.6 p -135.02 167.23 21.32 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.2 0.524 . . . . 0.0 111.378 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -70.66 -34.71 72.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.845 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 49' ' ' PHE . . . -64.08 -46.62 83.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.384 178.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -54.98 -47.77 74.15 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.092 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.422 ' O ' HG23 ' A' ' 51' ' ' ILE . 35.0 tt0 -59.79 -56.37 22.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.044 176.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 12.6 m-80 -53.82 -42.19 68.15 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.197 -176.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.436 ' HD1' ' O ' ' A' ' 45' ' ' ALA . 22.6 m-85 -67.19 -44.9 78.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 9.2 tp -75.52 -32.14 24.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 120.441 -0.504 . . . . 0.0 111.828 -174.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.577 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 36.1 pt -70.45 -7.09 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.057 0.456 . . . . 0.0 110.981 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' ASN . 26.1 mt-30 -87.13 -23.13 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.678 174.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -89.28 -21.49 23.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.093 0.473 . . . . 0.0 110.156 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 71.2 mt -78.05 145.03 36.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.126 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.424 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.8 t70 -77.65 127.85 33.14 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 176.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.563 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 59.1 mtt180 -75.86 24.67 0.12 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 -171.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.811 ' HG2' HD22 ' A' ' 58' ' ' LEU . 3.9 ptp180 -124.38 -15.75 6.58 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.075 175.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.811 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.4 mm? -95.7 161.99 13.8 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.278 0.561 . . . . 0.0 111.624 -179.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.5 m -118.29 117.08 28.13 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.225 175.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.728 ' HB3' HG13 ' A' ' 125' ' ' ILE . 87.0 m-85 -102.09 124.86 48.43 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -169.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.493 ' HA ' HG12 ' A' ' 103' ' ' VAL . 8.2 m-85 -58.85 135.73 57.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.843 0.354 . . . . 0.0 111.812 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.454 HD11 HD13 ' A' ' 104' ' ' LEU . 68.0 mt -115.85 175.0 5.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.272 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -75.61 -15.91 80.96 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.918 -0.658 . . . . 0.0 114.176 -174.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.574 HD11 ' HB3' ' A' ' 73' ' ' TRP . 47.6 tp -71.08 120.26 16.4 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.956 0.878 . . . . 0.0 110.88 -172.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -116.79 137.82 51.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.956 -174.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.542 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 6.6 t70 -113.21 139.02 49.13 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 158.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 26.0 tt0 -114.34 92.38 3.94 Favored 'General case' 0 C--N 1.31 -1.118 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.435 -173.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.547 ' HA ' ' H ' ' A' ' 99' ' ' GLU . 0.2 OUTLIER 76.09 -63.79 0.38 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 124.311 1.007 . . . . 0.0 110.001 -176.145 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 179.3 77.99 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.424 1.078 . . . . 0.0 108.69 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 51.8 mttp -121.76 125.94 47.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.767 -176.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -77.54 54.55 3.68 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.301 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -154.4 66.14 0.7 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.363 0.602 . . . . 0.0 110.182 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.574 ' HB3' HD11 ' A' ' 64' ' ' LEU . 91.1 m95 -57.78 128.77 38.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.707 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.723 ' HD3' ' HA ' ' A' ' 78' ' ' GLN . 13.3 ttm180 -137.93 149.63 46.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.338 -177.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.637 ' HB2' ' HB ' ' A' ' 79' ' ' THR . 95.6 m95 -80.33 109.24 14.62 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 171.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.566 HG13 ' H ' ' A' ' 77' ' ' ASP . 2.8 p 28.25 -72.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 175.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.566 ' H ' HG13 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -78.85 -86.75 0.07 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.954 0.407 . . . . 0.0 111.56 -173.41 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.723 ' HA ' ' HD3' ' A' ' 74' ' ' ARG . 21.6 tp60 -145.99 -1.72 0.75 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.1 0.476 . . . . 0.0 109.87 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.637 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 71.4 m -60.46 117.48 24.95 Favored Pre-proline 0 N--CA 1.452 -0.367 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.384 178.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 28.5 Cg_exo -63.85 147.11 92.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 123.177 2.585 . . . . 0.0 112.978 -176.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -63.39 147.01 52.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.472 179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -83.6 124.7 75.07 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.304 -177.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.71 -2.66 12.9 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.651 2.234 . . . . 0.0 113.86 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.638 ' HA ' ' HE ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -130.39 -34.53 1.6 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.108 -0.637 . . . . 0.0 111.79 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -83.47 82.53 8.25 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.969 0.414 . . . . 0.0 110.016 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.87 111.0 28.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.762 -178.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -121.09 91.88 3.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.022 -175.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 66.9 m95 -99.68 -178.44 3.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 110.98 178.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.673 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 72.9 m-70 -123.53 137.57 54.74 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.574 172.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.05 12.87 3.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.855 0.836 . . . . 0.0 110.269 176.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -112.31 37.78 2.92 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.324 -1.307 . . . . 0.0 109.738 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -61.95 147.02 90.74 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.871 -178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.31 167.69 26.23 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.793 2.329 . . . . 0.0 112.76 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -56.26 -56.7 17.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.086 -179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -144.01 113.76 7.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.919 -178.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.8 p -113.08 19.17 17.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.191 0.519 . . . . 0.0 110.327 175.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -73.6 135.12 43.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.169 -179.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 106.82 88.13 2.0 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 110.944 -0.863 . . . . 0.0 110.944 -175.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.547 ' H ' ' HA ' ' A' ' 68' ' ' ASN . 1.1 mp0 44.45 84.61 0.02 OUTLIER 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.256 0.623 . . . . 0.0 111.962 -170.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.542 ' HB3' ' HB3' ' A' ' 66' ' ' ASP . 35.1 t30 -97.23 118.62 34.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.6 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 59.2 m -120.85 132.92 55.27 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.594 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 15.5 m -88.8 141.85 13.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.291 0.567 . . . . 0.0 111.035 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' A' ' 61' ' ' PHE . 27.8 m -115.67 152.65 17.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.82 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.454 HD13 HD11 ' A' ' 62' ' ' LEU . 16.7 tp -83.55 101.85 11.74 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 174.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p -118.68 142.51 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.283 0.563 . . . . 0.0 111.283 -175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.418 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 88.2 t80 -77.86 117.89 19.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.47 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.673 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 22.7 t-20 -151.48 116.38 5.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.467 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 66.03 46.65 2.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.402 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 74.31 -25.45 0.2 Allowed 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.371 1.044 . . . . 0.0 112.231 177.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 12.3 pttm -106.22 146.04 30.8 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.457 0.646 . . . . 0.0 111.45 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.577 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 61.5 m95 -91.73 136.36 33.2 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.193 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.478 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -156.04 171.33 20.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.594 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 6.9 m0 -77.84 138.7 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 123.302 0.377 . . . . 0.0 110.451 -175.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -130.37 129.88 43.67 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.47 124.4 23.47 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.572 0.545 . . . . 0.0 111.417 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.4 m -146.41 157.72 48.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.86 138.46 85.85 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.026 1.817 . . . . 0.0 111.467 174.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 56.5 m -62.76 -20.1 64.63 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.14 0.495 . . . . 0.0 110.356 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -98.12 80.65 2.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.729 0.776 . . . . 0.0 109.11 172.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -155.26 110.09 2.98 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.434 -1.257 . . . . 0.0 108.232 177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 21' ' ' ASN . 5.6 mp0 -63.28 110.27 1.84 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.102 0.477 . . . . 0.0 111.224 -175.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -140.35 -174.03 3.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.553 178.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.6 p -83.15 171.61 13.51 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.635 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -147.92 147.98 30.3 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.909 0.385 . . . . 0.0 111.906 -170.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.728 HG13 ' HB3' ' A' ' 60' ' ' TYR . 43.7 mt -117.43 131.76 69.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.3 t -117.54 133.8 55.56 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' A' ' 15' ' ' TYR . 21.3 ptmt -123.2 139.91 53.57 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.973 0.416 . . . . 0.0 110.39 -178.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.614 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 10.9 tt -131.42 140.44 38.45 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.44 163.76 36.81 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 121.668 1.578 . . . . 0.0 110.749 170.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.56 ' HA3' ' HB2' ' A' ' 1' ' ' MET . . . -72.04 59.66 1.41 Allowed Glycine 0 C--O 1.227 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 111.967 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 15.2 t -96.52 14.76 23.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.054 0.454 . . . . 0.0 110.703 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 23.3 m -57.7 -32.4 67.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.728 ' H ' HD12 ' A' ' 133' ' ' LEU . 2.9 mp -71.18 -43.36 67.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.162 179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -67.2 -26.31 66.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.468 0.652 . . . . 0.0 110.244 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.28 25.22 1.96 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.317 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 9.2 pt-20 -54.5 -51.43 65.12 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.712 0.291 . . . . 0.0 111.401 -178.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' HG3' ' A' ' 141' ' ' GLN . 0.2 OUTLIER -74.13 -32.25 63.09 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -178.907 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.37 -46.77 88.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -69.42 -29.31 67.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.509 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -67.46 -23.8 65.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.706 178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 27.7 mt-30 -86.72 -5.57 59.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.642 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.311 -0.852 . . . . 0.0 110.909 -177.566 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 110.623 -0.139 . . . . 0.0 110.623 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.5 p -159.67 155.93 3.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.555 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 13.8 p -150.01 170.63 7.4 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.555 ' HD2' ' HB2' ' A' ' 3' ' ' CYS . 79.4 Cg_exo -48.89 139.88 24.5 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 122.542 2.161 . . . . 0.0 112.313 176.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 tt -72.37 89.19 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-O 121.946 0.879 . . . . 0.0 110.741 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -172.81 -52.48 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.283 -1.326 . . . . 0.0 108.101 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.4 m95 -75.19 128.42 35.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.098 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.4 tpt180 -74.33 104.22 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.15 0.5 . . . . 0.0 110.686 -177.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' CYS . . . -70.55 134.44 47.67 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.959 177.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.42 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 74.9 t80 -144.49 124.7 13.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.573 178.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 64.0 -82.21 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.353 0.661 . . . . 0.0 111.392 -176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.0 m -146.19 6.99 1.02 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.861 0.362 . . . . 0.0 110.878 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -120.77 166.67 13.41 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 -179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 69.9 m -122.61 126.93 48.69 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.42 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 32.6 m-85 -120.15 117.05 26.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.456 -174.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.487 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 67.5 t80 -111.66 115.64 51.15 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 0.0 110.703 178.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 2.0 Cg_endo -85.79 122.41 2.29 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.294 2.662 . . . . 0.0 112.203 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.91 138.4 41.21 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.752 0.31 . . . . 0.0 110.342 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.4 p -89.03 -4.28 58.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.32 0.581 . . . . 0.0 109.907 174.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.429 ' OD2' ' HD2' ' A' ' 22' ' ' LYS . 7.1 t70 -66.2 139.97 58.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.919 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -97.28 123.69 41.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.58 -174.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.429 ' HD2' ' OD2' ' A' ' 20' ' ' ASP . 5.9 mttp -155.54 158.81 39.06 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.958 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.628 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 72.6 p -70.74 167.16 19.36 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 174.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.727 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.6 t90 -61.07 -35.19 76.3 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.001 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -63.62 -52.23 61.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.71 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.1 -40.5 96.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.565 ' HB3' HD11 ' A' ' 38' ' ' LEU . 47.6 m -58.05 -40.38 80.8 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.288 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.437 ' HA ' HD21 ' A' ' 38' ' ' LEU . 43.9 tt0 -74.03 -26.22 60.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.12 -178.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 32.4 mtm180 -79.03 -45.1 20.87 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.09 0.471 . . . . 0.0 110.961 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.1 -37.87 88.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.722 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.5 m -85.57 178.9 7.23 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 171.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.514 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 24.9 m 76.85 -47.19 0.52 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 122.903 0.481 . . . . 0.0 111.138 -178.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.53 -20.19 67.61 Favored Glycine 0 CA--C 1.519 0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.109 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.4 mtm -93.15 6.73 46.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.699 0.285 . . . . 0.0 110.573 176.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 82.1 -5.93 69.48 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.725 -175.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.42 179.43 5.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.458 -0.371 . . . . 0.0 110.701 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.727 ' HB3' HG13 ' A' ' 76' ' ' VAL . 97.3 m-70 -147.45 169.57 19.24 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 27' ' ' SER . 3.9 mm? -59.05 154.72 15.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.865 0.302 . . . . 0.0 111.283 179.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.949 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 13.7 tpt -49.77 108.47 0.21 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.458 -178.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.595 ' HA ' ' CE3' ' A' ' 75' ' ' TRP . 70.3 p -108.15 108.04 18.93 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.283 0.563 . . . . 0.0 110.246 177.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.529 HD11 HD11 ' A' ' 104' ' ' LEU . 60.9 mt -73.42 103.09 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.453 -178.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 24.4 m -77.99 -48.7 15.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.06 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 55.5 p -125.42 170.15 11.67 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.85 0.833 . . . . 0.0 111.871 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -61.82 -25.84 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.336 175.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.55 -41.68 72.15 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.285 177.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 43' ' ' THR . 1.9 mp0 -48.25 -54.88 12.06 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.209 0.528 . . . . 0.0 109.588 171.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.805 HE22 HD13 ' A' ' 51' ' ' ILE . 0.8 OUTLIER -55.31 -59.97 4.06 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.623 -179.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -58.55 -40.51 83.24 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -173.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -84.44 -36.39 22.38 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.61 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.0 tp -69.25 -33.36 57.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.051 -0.66 . . . . 0.0 110.824 -176.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.805 HD13 HE22 ' A' ' 47' ' ' GLN . 43.0 pt -69.99 -10.33 13.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -178.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -76.01 -33.99 59.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.926 0.394 . . . . 0.0 110.0 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.89 -25.65 24.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.552 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 80.6 mt -67.94 140.2 56.43 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.662 -178.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.534 ' HB3' HD23 ' A' ' 58' ' ' LEU . 11.3 t70 -77.4 128.84 34.95 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.571 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 82.5 mtt180 -81.04 7.42 10.88 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -167.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.928 ' HG2' HD22 ' A' ' 58' ' ' LEU . 5.0 ptp180 -103.8 -13.5 16.4 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.01 176.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.928 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -101.52 150.29 23.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.059 0.457 . . . . 0.0 110.912 179.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.1 m -107.15 124.52 49.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 173.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.624 ' HB3' HG13 ' A' ' 125' ' ' ILE . 88.6 m-85 -105.89 122.38 46.0 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -172.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.762 ' HA ' HG12 ' A' ' 103' ' ' VAL . 21.5 m-85 -59.92 140.63 56.55 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.633 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.58 HD21 ' HG ' ' A' ' 104' ' ' LEU . 82.4 mt -107.68 168.22 9.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.397 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -92.84 25.48 19.15 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.966 -0.635 . . . . 0.0 113.148 -177.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.654 ' HG ' ' HE3' ' A' ' 73' ' ' TRP . 38.7 tp -92.87 109.03 20.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HE ' ' HH2' ' A' ' 24' ' ' TRP . 13.2 ttm180 -96.34 122.07 38.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -173.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -104.59 154.26 20.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 157.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 68' ' ' ASN . 27.8 tt0 -135.24 95.82 3.37 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 119.39 -0.924 . . . . 0.0 111.284 -174.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.741 ' HA ' ' O ' ' A' ' 98' ' ' GLY . 18.5 m120 78.7 -45.29 0.38 Allowed 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.188 175.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 68' ' ' ASN . . . 165.14 -6.34 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.981 -171.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 35.1 mttp -68.09 94.03 0.47 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 172.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -69.0 72.56 0.39 Allowed Glycine 0 C--N 1.329 0.162 0 O-C-N 123.649 0.593 . . . . 0.0 113.266 -176.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -125.22 74.45 1.38 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 176.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HE3' ' HG ' ' A' ' 64' ' ' LEU . 92.1 m95 -68.19 104.88 1.93 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.303 -175.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -134.15 152.34 51.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.164 177.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.595 ' CE3' ' HA ' ' A' ' 40' ' ' THR . 85.5 m95 -85.88 147.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 120.256 -0.578 . . . . 0.0 109.599 177.499 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.727 HG13 ' HB3' ' A' ' 37' ' ' HIS . 11.3 p -77.53 -6.76 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -167.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -100.69 -60.05 1.59 Allowed 'General case' 0 C--N 1.326 -0.432 0 O-C-N 121.334 -0.854 . . . . 0.0 111.214 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.403 ' H ' ' H ' ' A' ' 79' ' ' THR . 0.0 OUTLIER -170.24 -21.57 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.172 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 37.3 m -60.33 122.07 64.48 Favored Pre-proline 0 C--O 1.24 0.592 0 CA-C-O 121.569 0.699 . . . . 0.0 111.811 -172.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 15.9 Cg_exo -71.12 157.31 57.91 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.223 2.615 . . . . 0.0 111.312 173.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -71.89 126.14 28.98 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.962 0.41 . . . . 0.0 110.466 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.507 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 19.7 m-80 -96.24 106.38 28.42 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.417 179.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -67.03 -29.45 40.31 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.517 2.144 . . . . 0.0 112.211 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 24.5 tpt180 -78.98 -22.89 44.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.736 177.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 73.0 mtt180 -117.97 31.34 6.75 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.246 -171.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 86' ' ' VAL . 7.1 p -88.78 91.6 3.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 122.116 0.96 . . . . 0.0 109.661 175.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.01 68.12 9.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.366 -169.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.421 ' CD1' HG22 ' A' ' 86' ' ' VAL . 79.0 m95 -74.23 143.8 44.96 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 172.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.587 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 83.6 m-70 -66.32 171.33 4.92 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 171.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.639 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -107.21 59.21 0.62 Allowed 'General case' 0 CA--C 1.5 -0.952 0 CA-C-O 122.758 1.266 . . . . 0.0 111.534 -176.353 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.421 ' HB2' ' OE1' ' A' ' 92' ' ' GLU . 2.6 m-80 -155.05 -53.67 0.09 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 111.843 -2.435 . . . . 0.0 108.316 175.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.553 ' HB3' HD21 ' A' ' 95' ' ' ASN . 1.9 mp0 -82.18 118.47 72.12 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 114.482 -1.236 . . . . 0.0 112.151 -173.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -93.66 -65.23 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 123.446 2.764 . . . . 0.0 110.666 165.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -146.94 126.75 13.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.58 170.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.553 HD21 ' HB3' ' A' ' 92' ' ' GLU . 44.1 m-80 -102.3 -30.77 10.88 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.63 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 70.4 m -159.63 92.3 1.03 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -174.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.81 HE21 ' HA ' ' A' ' 97' ' ' GLN . 0.0 OUTLIER -77.57 85.0 3.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.56 0.695 . . . . 0.0 109.909 167.834 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.741 ' O ' ' HA ' ' A' ' 68' ' ' ASN . . . -125.32 -55.36 0.17 Allowed Glycine 0 CA--C 1.507 -0.459 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 176.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.673 ' HA ' ' H ' ' A' ' 68' ' ' ASN . 0.0 OUTLIER -133.48 -43.22 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 161.267 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.8 t30 69.53 123.44 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 166.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -154.83 160.7 41.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 173.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.461 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.3 m -107.65 148.02 12.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.17 0.509 . . . . 0.0 112.171 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.762 HG12 ' HA ' ' A' ' 61' ' ' PHE . 21.4 m -125.74 156.69 35.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.563 175.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.58 ' HG ' HD21 ' A' ' 62' ' ' LEU . 15.4 mt -86.53 118.39 25.92 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 171.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.3 p -134.81 143.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.601 179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.4 ' HD2' ' NE1' ' A' ' 111' ' ' TRP . 34.5 t80 -80.56 105.72 12.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.754 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.424 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 48.1 t30 -156.81 140.03 15.57 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.155 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.442 ' O ' ' HB3' ' A' ' 109' ' ' ASP . 41.9 mt-30 67.34 40.7 2.65 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 123.831 0.707 . . . . 0.0 109.688 -175.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 108' ' ' GLN . 31.2 t70 78.82 -16.22 0.69 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.493 174.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.75 170.79 15.41 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.477 0.656 . . . . 0.0 112.213 -174.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.571 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 72.2 m95 -88.07 130.63 34.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.539 173.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.587 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . . . -153.04 171.1 18.91 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.409 ' HE1' HD12 ' A' ' 41' ' ' ILE . 26.7 m0 -78.01 131.88 37.56 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 123.554 0.534 . . . . 0.0 110.807 -173.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -121.17 127.95 52.03 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.087 174.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.4 ' CG ' HD22 ' A' ' 95' ' ' ASN . 9.8 p-10 -82.8 125.69 31.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.254 0.549 . . . . 0.0 110.59 -179.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 21.9 m -141.33 155.23 67.78 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.159 179.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.89 133.12 53.88 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.18 1.92 . . . . 0.0 111.246 172.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.727 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 66.3 m -68.71 -15.77 63.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.181 -178.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -77.24 -7.77 56.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.996 0.427 . . . . 0.0 110.651 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -83.59 140.98 31.89 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 171.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -104.52 145.21 30.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.223 0.535 . . . . 0.0 111.33 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -159.8 -168.78 2.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.353 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 50.3 m -78.39 170.82 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 176.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.464 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 12.9 ptt180 -152.17 148.07 27.18 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.944 -171.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.3 mt -113.23 135.26 53.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.5 t -114.31 130.78 56.67 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -115.54 131.94 56.78 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.655 -175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.543 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.2 tt -127.54 138.5 32.96 Favored Pre-proline 0 C--N 1.32 -0.702 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 175.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -64.48 166.32 17.79 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.048 1.832 . . . . 0.0 111.042 171.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -70.13 82.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.924 177.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 17.0 p -76.36 18.53 0.3 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 122.818 0.447 . . . . 0.0 111.797 -177.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 9.4 t -65.36 -14.41 60.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.106 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -69.69 -29.48 66.91 Favored 'General case' 0 C--O 1.225 -0.227 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.505 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.412 HD22 ' C ' ' A' ' 134' ' ' ASN . 0.2 OUTLIER -73.48 -38.9 65.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.97 28.2 1.64 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.967 177.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 137' ' ' ASN . 7.8 pt-20 -52.31 -51.65 57.43 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.374 0.421 . . . . 0.0 112.005 -175.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.434 ' N ' ' HG3' ' A' ' 136' ' ' GLU . 28.7 p-10 -80.5 -27.53 37.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.653 0.264 . . . . 0.0 110.895 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.8 tt -64.2 -49.78 70.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -73.54 -22.32 60.12 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -67.69 -33.1 74.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.084 0.469 . . . . 0.0 110.061 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 137' ' ' ASN . 20.6 mt-30 -88.14 -6.17 58.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.413 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.4 t . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.026 -175.339 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.613 ' HG3' ' HA3' ' A' ' 130' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 108.652 -0.869 . . . . 0.0 108.652 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.575 ' HB ' ' CG2' ' A' ' 132' ' ' THR . 60.4 t -73.23 116.97 16.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.405 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 75.8 m -152.27 168.87 10.47 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 -177.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 52.0 Cg_exo -55.13 147.36 54.55 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.016 1.811 . . . . 0.0 111.258 172.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.1 mt -61.14 -24.93 34.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-O 121.182 0.515 . . . . 0.0 110.966 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -59.7 -58.22 9.51 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.418 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.409 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 33.4 m95 -64.71 138.7 58.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.212 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.491 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 1.7 tpp180 -86.0 106.88 17.48 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.092 0.472 . . . . 0.0 110.743 -176.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.25 122.54 26.44 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.38 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.453 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 65.7 t80 -140.14 119.04 12.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 176.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 56.76 -129.6 1.78 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.111 -172.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -88.4 -4.94 58.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.706 0.289 . . . . 0.0 111.138 -178.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -105.67 169.17 8.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.136 0.493 . . . . 0.0 111.524 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.5 m -139.6 135.54 33.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.149 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 17.4 m-85 -124.43 129.64 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.932 -172.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 40.3 t80 -116.46 114.16 40.48 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.092 -0.243 . . . . 0.0 110.398 175.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.2 Cg_endo -88.77 130.97 2.27 Favored 'Trans proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.334 2.689 . . . . 0.0 112.4 177.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 123' ' ' SER . 5.8 mp -107.63 140.5 40.56 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.52 60.2 1.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.398 0.618 . . . . 0.0 112.121 -171.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HA ' ' O ' ' A' ' 122' ' ' ALA . 1.3 t70 82.44 -168.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.172 -1.376 . . . . 0.0 112.292 165.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 65.1 27.44 12.45 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.099 -178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -141.81 141.44 33.15 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 121.347 0.594 . . . . 0.0 110.962 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.7 p -91.94 166.2 12.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.058 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.655 ' CH2' ' HG3' ' A' ' 65' ' ' ARG . 58.7 t90 -64.91 -34.78 79.22 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.3 -177.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.58 -51.88 68.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.34 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -59.67 -43.49 93.97 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.185 176.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.536 ' HB3' HD11 ' A' ' 38' ' ' LEU . 69.0 m -55.01 -46.92 75.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.468 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -68.91 -26.05 64.9 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.103 0.478 . . . . 0.0 110.942 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -83.66 -30.24 26.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.815 0.341 . . . . 0.0 110.989 178.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.59 -42.68 19.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.569 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 89.4 m -101.26 128.67 47.28 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 p 154.31 -65.06 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 O-C-N 124.668 1.23 . . . . 0.0 108.78 -174.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.52 -19.37 72.75 Favored Glycine 0 C--O 1.227 -0.295 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.917 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.8 mtm -78.53 1.06 23.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.751 0.31 . . . . 0.0 110.564 177.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 86.82 -11.88 63.22 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.752 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -96.49 161.98 13.67 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.576 -178.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.449 ' HB3' HG23 ' A' ' 76' ' ' VAL . 28.3 m-70 -130.25 170.41 14.13 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.536 HD11 ' HB3' ' A' ' 27' ' ' SER . 4.5 mm? -56.89 148.44 20.94 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 173.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.77 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 14.9 tpt -46.65 106.64 0.09 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.833 0.708 . . . . 0.0 112.57 -174.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.533 HG22 ' CE3' ' A' ' 75' ' ' TRP . 24.3 p -105.9 89.08 2.97 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.182 177.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 30.1 mt -65.69 110.85 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.152 0.501 . . . . 0.0 110.26 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 4.6 m -102.34 -30.8 10.84 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.941 -175.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.523 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 32.0 p -131.61 155.25 47.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.461 0.648 . . . . 0.0 112.309 -177.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -62.35 -46.78 87.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.988 178.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.5 -39.2 79.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.59 178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 43' ' ' THR . 84.1 tt0 -52.46 -57.25 10.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.673 176.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.402 ' O ' HG23 ' A' ' 51' ' ' ILE . 57.2 tt0 -61.04 -50.91 71.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.928 179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -57.22 -31.34 65.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -174.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -88.28 -36.53 16.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.1 tp -73.1 -30.25 31.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.836 -176.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.598 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.2 pt -71.67 -4.53 4.81 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-O 121.063 0.459 . . . . 0.0 110.997 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -87.85 -27.26 22.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.932 174.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -87.91 -22.97 24.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.642 179.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 73.7 mt -70.54 149.93 46.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.86 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.2 m-20 -57.73 -28.34 63.79 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.928 -177.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.649 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 60.0 mtt180 64.5 20.35 12.12 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.668 0.747 . . . . 0.0 109.273 -168.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.413 ' HB3' ' HB3' ' A' ' 55' ' ' ASP . 7.3 ttp180 -120.69 -21.7 6.6 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.076 -176.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -117.85 169.99 9.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.225 0.536 . . . . 0.0 111.552 -174.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.7 p -107.43 122.1 45.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.257 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -104.67 120.51 41.51 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.598 0.221 . . . . 0.0 111.598 -172.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.435 ' HZ ' ' O ' ' A' ' 120' ' ' PHE . 44.7 m-85 -55.19 136.97 48.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.021 0.439 . . . . 0.0 111.851 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.617 HD21 ' HB2' ' A' ' 104' ' ' LEU . 78.0 mt -108.21 -175.07 2.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.276 177.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.447 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -96.07 11.35 67.64 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.965 -174.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.559 ' HB3' HG22 ' A' ' 102' ' ' VAL . 28.7 tp -80.05 119.44 22.88 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 177.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.655 ' HG3' ' CH2' ' A' ' 24' ' ' TRP . 31.1 ttt-85 -111.81 126.25 54.88 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -165.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -133.75 149.95 51.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.428 -0.805 . . . . 0.0 108.945 164.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 2.4 pt-20 -148.46 119.96 7.95 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.007 0.432 . . . . 0.0 110.477 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 58.01 33.97 23.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.613 176.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.593 ' N ' ' HA2' ' A' ' 98' ' ' GLY . . . 67.99 80.79 0.2 Allowed 'General case' 0 C--O 1.233 0.233 0 O-C-N 123.744 0.653 . . . . 0.0 112.023 175.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 58.0 mttp -129.03 113.03 14.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.663 175.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.5 59.74 1.2 Allowed Glycine 0 CA--C 1.519 0.313 0 C-N-CA 121.288 -0.482 . . . . 0.0 113.088 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -137.59 70.28 1.4 Allowed 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -61.13 108.66 0.93 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.966 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 74' ' ' ARG . 55.1 mtm-85 -141.38 172.41 12.72 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.533 ' CE3' HG22 ' A' ' 40' ' ' THR . 97.4 m95 -86.11 173.29 9.95 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 174.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.449 HG23 ' HB3' ' A' ' 37' ' ' HIS . 19.6 m -78.33 39.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.176 0.512 . . . . 0.0 111.265 179.304 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.441 ' CG ' ' H ' ' A' ' 78' ' ' GLN . 11.3 t70 -164.74 -160.16 0.49 Allowed 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -176.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.441 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 22.4 tp60 -78.67 -6.44 55.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.428 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 3.5 m -74.0 120.85 83.39 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.834 -177.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 3.4 Cg_exo -78.34 155.59 28.78 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.946 2.431 . . . . 0.0 111.651 176.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -64.86 133.15 51.27 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.935 0.397 . . . . 0.0 110.368 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.649 ' HB2' ' HB2' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -101.44 115.55 64.88 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.67 -179.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.88 -9.59 25.34 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.695 2.263 . . . . 0.0 112.319 177.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.426 ' HD3' HH11 ' A' ' 84' ' ' ARG . 6.1 tpp180 -110.1 1.52 18.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.161 0.505 . . . . 0.0 110.238 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.649 ' HB2' ' HB2' ' A' ' 82' ' ' ASN . 20.2 mmt180 -128.77 57.29 1.62 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.346 0.593 . . . . 0.0 110.048 178.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 8.2 p -138.25 139.67 41.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.239 -0.892 . . . . 0.0 109.609 178.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -127.51 76.4 1.67 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.716 0.293 . . . . 0.0 110.565 -177.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -67.97 -176.05 0.64 Allowed 'General case' 0 C--O 1.24 0.576 0 CA-C-O 121.655 0.741 . . . . 0.0 112.439 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 1.2 m-70 -101.64 -154.93 0.5 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.478 -178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.657 ' HB2' HE22 ' A' ' 108' ' ' GLN . 72.9 mmtt -129.24 9.14 5.62 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-O 121.694 0.759 . . . . 0.0 109.369 172.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.446 ' H ' ' HB3' ' A' ' 89' ' ' HIS . 6.7 t30 -164.25 81.63 0.41 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.321 179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -109.87 142.93 26.87 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.393 175.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -81.24 158.05 20.02 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.89 2.393 . . . . 0.0 113.28 -176.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -101.92 -2.66 29.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.759 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -57.13 -44.8 83.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.185 -172.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.433 ' HB2' ' ND2' ' A' ' 100' ' ' ASN . 0.0 OUTLIER -77.07 119.85 21.34 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.067 0.461 . . . . 0.0 111.471 -176.422 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -136.38 88.12 2.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.302 173.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.593 ' HA2' ' N ' ' A' ' 69' ' ' ALA . . . 123.36 111.56 2.02 Favored Glycine 0 N--CA 1.442 -0.961 0 N-CA-C 110.606 -0.997 . . . . 0.0 110.606 -173.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.547 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 97.7 mt-10 73.07 50.05 0.15 Allowed 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 -174.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.433 ' ND2' ' HB2' ' A' ' 96' ' ' SER . 12.1 m120 -86.51 106.12 17.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.455 178.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.7 m -119.87 123.25 43.16 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.045 0.45 . . . . 0.0 110.398 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.559 HG22 ' HB3' ' A' ' 64' ' ' LEU . 35.2 m -80.77 135.6 24.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.068 0.461 . . . . 0.0 110.526 178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 27.7 m -115.39 147.57 18.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.826 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.617 ' HB2' HD21 ' A' ' 62' ' ' LEU . 28.0 tp -83.16 101.73 11.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 175.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.3 p -121.83 145.58 28.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 -174.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.419 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 29.7 t80 -86.08 99.41 11.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.538 177.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.51 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 27.3 t-20 -149.48 137.28 20.33 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.657 HE22 ' HB2' ' A' ' 90' ' ' LYS . 92.2 mt-30 69.83 24.71 5.21 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -171.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 34.2 t70 71.18 -11.3 0.69 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.098 -1.41 . . . . 0.0 111.637 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HZ2' ' HB2' ' A' ' 112' ' ' ALA . 14.5 ptmm? -109.04 150.67 27.45 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.0 110.304 -178.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.649 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 95.1 m95 -77.42 130.83 37.58 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.432 ' HB2' ' HZ2' ' A' ' 110' ' ' LYS . . . -152.47 156.41 39.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.823 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.554 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 17.8 m0 -81.14 115.31 20.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.37 -178.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -107.03 133.88 51.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -77.89 124.09 27.57 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 123.257 0.348 . . . . 0.0 111.07 -179.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.407 HG21 ' CE1' ' A' ' 120' ' ' PHE . 3.3 m -149.56 158.52 37.71 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.974 176.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.547 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 17.7 Cg_endo -60.89 137.32 71.66 Favored 'Trans proline' 0 CA--C 1.531 0.338 0 C-N-CA 122.282 1.988 . . . . 0.0 111.787 175.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.554 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 41.8 m -64.67 -23.85 67.39 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -173.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -94.39 15.14 18.42 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.023 -0.423 . . . . 0.0 111.169 -174.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.495 ' CZ ' ' HB2' ' A' ' 122' ' ' ALA . 0.1 OUTLIER -84.55 140.42 31.43 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 174.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.91 128.45 35.54 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.788 -177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.495 ' HB2' ' CZ ' ' A' ' 120' ' ' PHE . . . -161.87 -169.24 2.16 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.242 0.544 . . . . 0.0 111.261 179.208 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.544 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 14.5 m -96.6 -176.58 3.65 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.615 177.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.455 ' HD3' ' OG ' ' A' ' 27' ' ' SER . 13.9 ptt-85 -165.41 170.08 14.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.045 0.45 . . . . 0.0 111.35 177.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 39' ' ' MET . 45.0 mt -122.35 135.73 61.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 6.1 t -103.43 129.16 50.48 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -111.95 113.08 25.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.823 -171.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.752 ' HB ' ' HB2' ' A' ' 36' ' ' ALA . 11.5 tt -124.85 138.78 32.04 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-O 120.867 0.365 . . . . 0.0 110.883 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -70.08 167.54 24.58 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 123.15 2.567 . . . . 0.0 111.99 170.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.613 ' HA3' ' HG3' ' A' ' 1' ' ' MET . . . -64.56 93.37 0.14 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.715 174.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 2.3 p -78.21 33.22 0.19 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -177.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.575 ' CG2' ' HB ' ' A' ' 2' ' ' VAL . 21.4 p -67.36 -17.13 64.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.996 0.427 . . . . 0.0 110.837 176.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 78.9 mt -73.38 -18.14 61.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.568 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -88.67 -56.52 3.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.284 0.564 . . . . 0.0 110.071 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.58 29.05 1.36 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.297 -175.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.45 ' CD ' ' H ' ' A' ' 137' ' ' ASN . 0.0 OUTLIER -63.12 -55.81 22.11 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -175.788 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.45 ' H ' ' CD ' ' A' ' 136' ' ' GLU . 5.3 p30 -80.86 -22.84 39.54 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.31 -39.48 93.14 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.394 177.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -81.6 -30.78 32.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.31 177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -67.73 -31.2 70.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.755 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -86.76 -5.41 59.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.74 178.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 43.2 t . . . . . 0 C--O 1.247 0.942 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.36 -175.657 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.517 ' HG3' ' HA ' ' A' ' 12' ' ' SER . 72.2 mtm . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.58 ' HB ' HD11 ' A' ' 133' ' ' LEU . 58.5 t -90.38 118.81 36.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB3' ' HD2' ' A' ' 4' ' ' PRO . 65.3 m -151.12 173.95 3.95 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 -178.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 3' ' ' CYS . 51.9 Cg_exo -53.83 148.53 37.03 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.057 1.838 . . . . 0.0 111.453 172.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.82 -29.93 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.925 0.393 . . . . 0.0 111.356 -172.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.09 -29.91 71.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.692 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CD1' ' HB2' ' A' ' 4' ' ' PRO . 23.6 m95 -88.26 125.83 34.85 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.583 -174.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 8' ' ' ARG . 16.6 tpt180 -73.6 99.86 3.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.195 0.522 . . . . 0.0 110.063 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.37 129.46 39.83 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.86 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.435 ' HB3' ' HE2' ' A' ' 15' ' ' TYR . 85.9 t80 -132.69 105.79 7.39 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.426 177.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 56.96 -103.57 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.786 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.517 ' HA ' ' HG3' ' A' ' 1' ' ' MET . 30.2 t -91.25 -37.94 12.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.626 -177.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -92.65 174.33 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.136 0.493 . . . . 0.0 111.729 -173.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' HB2' HG22 ' A' ' 128' ' ' ILE . 78.2 m -141.2 127.5 19.79 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.407 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.435 ' HE2' ' HB3' ' A' ' 10' ' ' PHE . 53.7 m-85 -120.58 127.25 51.96 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.386 -171.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.414 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 53.8 t80 -117.94 114.66 37.17 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-O 120.781 0.324 . . . . 0.0 110.408 176.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 5.2 Cg_endo -88.11 128.01 2.22 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 123.247 2.631 . . . . 0.0 112.075 176.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 mp -112.05 138.57 48.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.009 178.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 p -89.43 2.69 54.14 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.527 0.68 . . . . 0.0 109.408 173.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 22' ' ' LYS . 3.9 t70 -66.48 133.52 50.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.002 179.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.703 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 16.5 p-10 -93.09 107.03 18.91 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.849 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.936 ' HB2' ' HD2' ' A' ' 124' ' ' ARG . 14.4 mptt -136.83 156.08 48.96 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.833 177.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 118' ' ' CYS . 76.4 p -76.46 167.57 21.61 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.653 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 39.5 t90 -58.89 -39.2 80.73 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.941 0.4 . . . . 0.0 110.771 -176.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.09 76.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.186 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.97 -34.48 77.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.044 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.9 t -58.45 -46.33 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.866 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.9 tp10 -74.9 -22.46 58.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.76 0.314 . . . . 0.0 110.39 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 -67.66 -45.81 74.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.782 0.325 . . . . 0.0 110.744 173.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.407 ' HB3' ' NH2' ' A' ' 124' ' ' ARG . 3.7 t-20 -71.97 -28.7 63.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.201 0.524 . . . . 0.0 109.949 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.52 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 65.3 m -84.13 177.13 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 173.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.41 ' HB3' ' O ' ' A' ' 31' ' ' CYS . 33.2 t 75.33 -34.82 0.26 Allowed 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.017 0.527 . . . . 0.0 110.919 -177.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.67 -29.27 71.57 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.97 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.52 ' SD ' ' HA ' ' A' ' 31' ' ' CYS . 1.5 pmm? -100.47 10.51 41.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.331 . . . . 0.0 110.368 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.75 19.82 67.17 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.524 -178.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.829 ' HB2' HG12 ' A' ' 128' ' ' ILE . . . -113.79 172.77 6.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.658 0.266 . . . . 0.0 111.39 -177.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.468 ' HD2' ' OD1' ' A' ' 77' ' ' ASP . 71.3 m-70 -140.48 169.2 18.11 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' HG23 ' A' ' 40' ' ' THR . 4.1 mm? -52.44 141.02 20.86 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.371 0.419 . . . . 0.0 110.922 173.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.572 ' HB2' ' HB ' ' A' ' 125' ' ' ILE . 15.8 tpt -36.26 111.15 0.13 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 124.145 0.903 . . . . 0.0 112.439 177.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.647 HG21 ' HB3' ' A' ' 77' ' ' ASP . 12.0 p -111.89 89.01 2.94 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.522 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.567 ' HA ' ' OE2' ' A' ' 46' ' ' GLU . 41.9 mt -64.65 114.83 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 114.88 -1.055 . . . . 0.0 110.486 -177.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 16.7 m -106.9 -22.78 12.58 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.832 -177.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.597 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 13.1 p -132.96 151.9 52.0 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 122.362 1.077 . . . . 0.0 113.182 -178.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.96 -50.63 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.041 -1.436 . . . . 0.0 111.548 -179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.424 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -59.36 -39.41 83.16 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.542 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' ' 43' ' ' THR . 61.8 tt0 -48.5 -58.93 3.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.183 176.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.505 ' HA ' HG22 ' A' ' 50' ' ' ILE . 23.0 tt0 -61.18 -44.66 96.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.932 -179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -61.96 -25.42 67.6 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -177.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.424 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 27.5 m-85 -88.53 -37.81 15.42 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.579 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.3 tp -71.88 -30.01 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 120.381 -0.528 . . . . 0.0 111.103 -176.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.465 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 35.8 pt -69.44 -5.79 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 121.032 0.444 . . . . 0.0 111.196 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -87.22 -25.29 24.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.211 177.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -92.97 -23.81 18.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.494 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 84.7 mt -76.55 144.43 39.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.043 -178.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.556 ' HB3' HD23 ' A' ' 58' ' ' LEU . 13.5 t70 -78.65 138.2 38.19 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 177.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.56 ' HD3' ' CE1' ' A' ' 106' ' ' TYR . 84.8 mtt180 -83.46 11.68 6.63 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -170.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.859 ' HG2' HD22 ' A' ' 58' ' ' LEU . 7.3 ptp180 -112.11 -11.08 13.84 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.755 176.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.859 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.6 mm? -100.22 166.91 10.76 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.271 0.558 . . . . 0.0 111.609 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.3 m -127.17 124.09 38.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.035 175.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.702 ' HB3' HG13 ' A' ' 125' ' ' ILE . 80.6 m-85 -109.07 121.95 46.23 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -169.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.463 ' HA ' HG12 ' A' ' 103' ' ' VAL . 19.1 m-85 -62.38 138.94 58.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.725 0.297 . . . . 0.0 111.791 177.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.626 HD23 HG12 ' A' ' 102' ' ' VAL . 1.4 mm? -110.92 173.36 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 174.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.641 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -87.73 60.65 4.19 Favored Glycine 0 C--O 1.225 -0.414 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.315 -177.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.461 HD23 ' HB ' ' A' ' 102' ' ' VAL . 3.3 mm? -109.55 126.42 53.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.724 0.262 . . . . 0.0 110.329 177.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.504 ' NH1' ' HB3' ' A' ' 67' ' ' GLU . 16.5 ttp85 -110.87 117.53 33.64 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.422 177.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -136.49 84.85 2.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.982 0.896 . . . . 0.0 108.998 164.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.504 ' HB3' ' NH1' ' A' ' 65' ' ' ARG . 3.3 tm-20 -91.15 123.82 34.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.499 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.404 ' HB3' ' NZ ' ' A' ' 70' ' ' LYS . 3.2 t-20 71.28 19.94 5.19 Favored 'General case' 0 N--CA 1.467 0.403 0 O-C-N 123.867 0.73 . . . . 0.0 110.191 178.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.37 75.14 0.33 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.127 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 52.0 mttp -101.95 -22.56 14.27 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.654 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 -8.17 62.79 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.568 176.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -86.07 65.14 8.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.554 0.692 . . . . 0.0 110.289 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -61.16 113.82 2.8 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.177 -178.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 -133.32 151.01 51.85 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.737 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.641 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 75.4 m95 -84.61 136.96 33.55 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.439 HG21 ' CZ2' ' A' ' 24' ' ' TRP . 10.5 t -79.2 47.98 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.662 0.744 . . . . 0.0 110.809 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.647 ' HB3' HG21 ' A' ' 40' ' ' THR . 33.9 t70 -162.09 32.67 0.12 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -178.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 76.76 -37.29 0.28 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 114.279 -1.328 . . . . 0.0 111.586 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.592 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 24.2 m -43.26 122.29 3.27 Favored Pre-proline 0 C--O 1.239 0.505 0 CA-C-O 121.531 0.681 . . . . 0.0 112.664 -176.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 14.8 Cg_exo -72.04 148.15 50.27 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 123.309 2.673 . . . . 0.0 111.644 174.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 75' ' ' TRP . 68.0 t80 -69.86 127.91 34.55 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.253 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.473 ' CB ' ' HB2' ' A' ' 85' ' ' ARG . 0.9 OUTLIER -89.65 115.98 65.2 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.347 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -67.65 -29.15 36.73 Favored 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.63 2.22 . . . . 0.0 112.651 179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -90.09 -22.56 21.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.802 0.334 . . . . 0.0 111.249 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.473 ' HB2' ' CB ' ' A' ' 82' ' ' ASN . 86.4 mtt180 -105.92 76.91 1.21 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.512 0.673 . . . . 0.0 110.484 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.0 p -136.41 131.02 47.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.944 179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -126.39 52.05 1.76 Allowed 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.701 -0.4 . . . . 0.0 111.909 -168.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.425 ' CH2' HG22 ' A' ' 102' ' ' VAL . 85.8 m95 -64.81 177.95 0.87 Allowed 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.454 0.645 . . . . 0.0 111.372 178.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.495 ' CE1' ' HB3' ' A' ' 107' ' ' ASN . 91.0 m-70 -79.3 126.54 30.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.536 172.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.74 ' HD3' ' H ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -58.55 108.48 0.64 Allowed 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.572 0.701 . . . . 0.0 109.648 174.733 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 25.1 t-20 61.05 90.13 0.07 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 114.295 -1.321 . . . . 0.0 108.784 -167.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.436 ' HG3' ' HB2' ' A' ' 89' ' ' HIS . 28.6 tt0 -101.61 105.14 39.0 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.18 -172.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 72.2 Cg_endo -82.06 -24.98 3.63 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.468 2.112 . . . . 0.0 111.101 172.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -86.92 83.34 7.54 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.077 176.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -148.22 144.57 27.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.079 -177.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 m -121.44 163.71 18.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.075 0.464 . . . . 0.0 111.821 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -135.66 124.75 24.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.352 175.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 134.75 -101.7 0.41 Allowed Glycine 0 N--CA 1.453 -0.197 0 N-CA-C 111.239 -0.745 . . . . 0.0 111.239 179.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 117' ' ' PRO . 37.4 mt-10 -88.95 66.69 7.97 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 167.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.493 ' HB2' ' OD1' ' A' ' 115' ' ' ASP . 4.2 p-10 -103.64 132.06 50.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.529 0.68 . . . . 0.0 111.891 -170.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.37 166.34 28.35 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.464 178.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.626 HG12 HD23 ' A' ' 62' ' ' LEU . 59.1 t -95.71 139.88 18.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -169.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.463 HG12 ' HA ' ' A' ' 61' ' ' PHE . 32.6 m -123.9 141.45 44.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.718 168.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.51 ' N ' HD21 ' A' ' 62' ' ' LEU . 13.9 tp -81.53 109.99 16.5 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.0 p -127.38 140.46 49.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.57 -172.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.56 ' CE1' ' HD3' ' A' ' 56' ' ' ARG . 66.5 t80 -88.25 96.09 10.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 173.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.495 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 49.5 t-20 -129.33 128.53 43.31 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -176.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 61.45 38.79 15.67 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 123.856 0.722 . . . . 0.0 109.987 -175.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.501 ' HA ' ' CZ ' ' A' ' 106' ' ' TYR . 10.5 m-20 65.56 16.9 10.73 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 114.246 -1.343 . . . . 0.0 113.15 174.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.42 ' HE2' ' HB2' ' A' ' 110' ' ' LYS . 10.9 ptmm? -132.49 137.09 47.08 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.903 172.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.465 ' CD1' ' HB ' ' A' ' 51' ' ' ILE . 89.8 m95 -70.8 130.35 41.46 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 170.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -157.0 168.81 26.38 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.471 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.404 ' HB3' HG13 ' A' ' 102' ' ' VAL . 37.0 m0 -79.15 142.16 36.61 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.292 177.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -136.25 122.17 20.04 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 177.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.493 ' OD1' ' HB2' ' A' ' 100' ' ' ASN . 13.5 t70 -84.17 123.6 30.26 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.902 -0.719 . . . . 0.0 110.702 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.449 ' HB ' ' HD2' ' A' ' 117' ' ' PRO . 21.3 m -139.23 159.94 64.27 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.458 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.572 ' HA ' ' O ' ' A' ' 99' ' ' GLU . 13.1 Cg_endo -57.38 131.32 44.04 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.53 2.153 . . . . 0.0 111.942 175.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.653 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 69.5 m -67.19 -12.75 60.88 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.19 0.519 . . . . 0.0 110.657 177.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -85.77 -2.78 58.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.55 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.476 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 83.5 t80 -88.0 138.35 31.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.109 175.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -92.96 135.91 33.73 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.906 0.384 . . . . 0.0 110.252 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.441 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -154.14 -173.21 4.49 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.969 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 39.2 m -74.29 160.45 31.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.985 0.421 . . . . 0.0 110.088 179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.936 ' HD2' ' HB2' ' A' ' 22' ' ' LYS . 48.4 mtp180 -127.26 145.85 50.63 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.587 -169.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.702 HG13 ' HB3' ' A' ' 60' ' ' TYR . 59.0 mt -124.65 119.63 56.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 166.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.54 132.8 53.47 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 178.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -112.91 126.54 55.58 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.075 0.464 . . . . 0.0 111.961 -174.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.829 HG12 ' HB2' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -111.38 134.74 21.09 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.941 175.562 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.482 ' HD2' HD13 ' A' ' 128' ' ' ILE . 6.6 Cg_exo -74.11 158.63 45.35 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.113 1.875 . . . . 0.0 111.164 173.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -75.41 49.59 2.33 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.007 177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 14.9 t -111.12 18.08 19.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.08 0.467 . . . . 0.0 110.521 -173.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.2 m -60.53 -21.91 63.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.227 0.536 . . . . 0.0 111.258 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.599 ' H ' HD12 ' A' ' 133' ' ' LEU . 3.9 mp -75.91 -28.9 58.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.102 179.121 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -87.82 -43.17 12.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.871 178.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 138' ' ' LEU . . . -85.79 61.13 6.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.172 -177.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -43.37 74.2 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.2 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -74.8 -30.08 61.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.222 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.563 ' HB3' ' HB1' ' A' ' 135' ' ' ALA . 3.1 tt -64.91 -45.28 86.53 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -63.82 -30.55 71.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.278 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -71.95 -35.64 69.64 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.812 178.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -86.64 -6.11 58.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.998 -176.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 29.4 t . . . . . 0 C--O 1.252 1.226 0 CA-C-O 118.148 -0.93 . . . . 0.0 110.785 -177.618 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.4 ' CE ' ' HA ' ' A' ' 8' ' ' ARG . 3.2 ptt? . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 88.3 t -74.92 112.98 13.07 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 CA-C-O 121.104 0.478 . . . . 0.0 111.386 -172.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.754 ' SG ' ' HD2' ' A' ' 4' ' ' PRO . 3.0 t -170.46 166.06 5.12 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 173.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.754 ' HD2' ' SG ' ' A' ' 3' ' ' CYS . 18.5 Cg_endo -64.96 119.42 6.45 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 N-CA-C 108.859 -1.247 . . . . 0.0 108.859 164.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.411 HG22 ' N ' ' A' ' 6' ' ' ASP . 5.3 mp 60.19 159.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -166.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.411 ' N ' HG22 ' A' ' 5' ' ' ILE . 10.7 t70 -79.96 72.76 6.74 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.117 -0.989 . . . . 0.0 110.394 -177.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.454 ' CE3' ' HB2' ' A' ' 16' ' ' PHE . 10.4 m0 -73.23 155.34 39.65 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.179 174.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 8' ' ' ARG . 18.3 tpt180 -72.87 102.07 3.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.067 0.461 . . . . 0.0 110.063 -177.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -87.19 124.91 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.112 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.47 ' HB3' ' CE1' ' A' ' 15' ' ' TYR . 66.9 t80 -120.36 110.98 17.18 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.177 174.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 66.88 -77.57 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.101 -176.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.5 t -149.07 17.33 0.96 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.926 0.393 . . . . 0.0 110.625 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.481 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 36.8 m-80 -125.92 151.01 47.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.463 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.758 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . 80.3 m -106.25 135.03 48.45 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.325 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.47 ' CE1' ' HB3' ' A' ' 10' ' ' PHE . 27.7 m-85 -129.24 134.72 48.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 178.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.511 ' HD2' HD22 ' A' ' 18' ' ' LEU . 8.4 t80 -123.73 113.23 28.77 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 16' ' ' PHE . 7.9 Cg_endo -89.68 118.35 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.533 2.822 . . . . 0.0 111.858 175.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.568 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.4 OUTLIER -132.24 140.47 48.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.371 0.605 . . . . 0.0 110.389 178.373 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 p -86.99 5.29 38.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.299 -169.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.406 ' OD1' ' HB2' ' A' ' 18' ' ' LEU . 2.8 m-20 -59.56 135.04 57.55 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.052 0.453 . . . . 0.0 110.174 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.676 ' O ' ' HD2' ' A' ' 22' ' ' LYS . 2.1 p-10 -96.28 102.3 14.07 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.022 -176.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.676 ' HD2' ' O ' ' A' ' 21' ' ' ASN . 13.4 mmmt -137.07 155.52 49.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 179.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 80.7 p -70.72 178.98 2.8 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.834 -176.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.559 ' CZ2' HG23 ' A' ' 76' ' ' VAL . 49.4 t90 -56.54 -52.7 63.79 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.12 0.486 . . . . 0.0 110.444 -179.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.633 ' O ' ' HG2' ' A' ' 29' ' ' ARG . . . -67.04 -43.72 82.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.293 -177.294 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.28 -31.54 64.13 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -174.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 p -67.26 -35.26 79.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.371 -0.532 . . . . 0.0 109.581 175.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' HB2' ' A' ' 38' ' ' LEU . 0.5 OUTLIER -66.25 -30.98 71.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.739 173.975 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.633 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 11.1 mmt-85 -83.24 -25.59 31.55 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.105 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -77.61 -26.39 50.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 74.7 m -85.87 178.88 7.15 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 166.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.743 ' HA ' ' O ' ' A' ' 36' ' ' ALA . 6.9 p 81.39 -41.23 0.15 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.79 0.836 . . . . 0.0 111.565 172.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.81 -23.09 58.49 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 116.202 -0.454 . . . . 0.0 113.008 178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 1.3 pmm? -100.62 15.73 27.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.658 0.266 . . . . 0.0 110.914 179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 79.18 47.59 7.43 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.2 -175.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' ' 32' ' ' SER . . . -142.98 -174.37 4.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.835 0.35 . . . . 0.0 110.649 -173.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.653 ' CD2' ' HB2' ' A' ' 77' ' ' ASP . 9.6 t60 -148.48 162.16 40.18 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 171.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.628 ' HB2' ' HG2' ' A' ' 28' ' ' GLU . 21.9 tp -56.95 145.73 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 174.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.2 ttt -60.4 113.67 2.53 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.542 0.686 . . . . 0.0 112.443 -173.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.783 ' HB ' HG12 ' A' ' 76' ' ' VAL . 0.9 OUTLIER -106.92 109.71 21.67 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.252 170.164 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 54.2 mt -64.6 111.68 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.975 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 11.1 m -97.16 -31.65 12.35 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.787 -174.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' ' HB3' ' A' ' 46' ' ' GLU . 21.9 p -128.04 153.27 46.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.85 0.833 . . . . 0.0 112.433 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.443 ' CG ' ' HG2' ' A' ' 85' ' ' ARG . 19.3 mt-10 -66.69 -36.12 81.77 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.965 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.99 -35.11 79.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.033 0.444 . . . . 0.0 110.425 176.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.565 ' HB3' ' O ' ' A' ' 43' ' ' THR . 81.8 tt0 -55.58 -54.54 42.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.42 ' O ' HG23 ' A' ' 51' ' ' ILE . 21.5 tm0? -57.74 -48.86 78.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.641 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -64.02 -27.73 69.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.277 -176.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -89.23 -41.24 12.32 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.9 tp -62.51 -35.52 70.43 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 -176.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.65 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 41.5 pt -68.1 -9.22 10.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.497 -178.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -82.81 -30.0 29.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.246 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.24 -28.8 25.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.694 -178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 69.4 mt -62.86 158.02 20.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.505 ' OD2' ' HB3' ' A' ' 57' ' ' ARG . 15.8 t70 -78.88 -2.45 39.92 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.994 -1.003 . . . . 0.0 112.975 -171.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.719 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 10.9 mpt_? 64.94 -57.51 0.27 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -172.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HB3' ' OD2' ' A' ' 55' ' ' ASP . 13.5 ttp180 -61.99 -27.73 69.07 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 122.982 0.513 . . . . 0.0 111.864 -176.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.51 147.32 24.04 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.367 0.603 . . . . 0.0 112.243 -175.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.9 m -100.93 130.54 46.94 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.72 172.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.47 ' HA ' ' O ' ' A' ' 123' ' ' SER . 86.2 m-85 -112.94 124.34 52.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -174.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -69.99 127.93 34.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.033 174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.562 HD21 ' HB2' ' A' ' 104' ' ' LEU . 0.3 OUTLIER -169.71 -177.48 2.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.648 179.334 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.414 ' HA2' ' CZ3' ' A' ' 75' ' ' TRP . . . 83.77 -115.03 3.98 Favored Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 115.23 0.852 . . . . 0.0 115.23 163.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 75' ' ' TRP . 3.2 mm? -93.67 154.32 17.88 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.132 -0.534 . . . . 0.0 110.577 -170.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.456 ' HD3' ' OE1' ' A' ' 67' ' ' GLU . 14.0 ttm180 -93.6 104.33 16.45 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.72 ' HB2' ' HA ' ' A' ' 101' ' ' CYS . 5.4 m-20 -97.0 75.4 2.64 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.993 0.902 . . . . 0.0 108.778 178.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 13.8 tt0 -112.39 121.16 44.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 114.574 -1.193 . . . . 0.0 110.624 -171.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 67.86 15.87 9.61 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.469 0.48 . . . . 0.0 110.688 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 55.91 35.1 24.85 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.492 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 23.8 mttm -64.46 137.21 57.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.407 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -68.59 -15.32 68.38 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.064 176.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -86.95 86.0 7.29 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.693 ' HZ3' ' HA ' ' A' ' 66' ' ' ASP . 71.9 m95 -75.54 133.7 40.93 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.09 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.568 HH21 ' HA ' ' A' ' 78' ' ' GLN . 73.2 ttt180 -150.47 149.11 29.56 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.502 ' HA ' HD13 ' A' ' 64' ' ' LEU . 78.0 m95 -69.66 169.92 11.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.34 0.591 . . . . 0.0 111.01 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.783 HG12 ' HB ' ' A' ' 40' ' ' THR . 8.8 p -62.57 -19.31 22.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.714 -178.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.653 ' HB2' ' CD2' ' A' ' 37' ' ' HIS . 20.5 t70 -147.67 103.57 3.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.471 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.568 ' HA ' HH21 ' A' ' 74' ' ' ARG . 45.4 tp60 64.88 -64.68 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 172.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.44 ' HA ' ' HD3' ' A' ' 80' ' ' PRO . 7.4 m -42.99 127.89 3.25 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 124.206 1.002 . . . . 0.0 112.963 -173.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 7.7 Cg_exo -74.89 159.68 41.44 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.087 2.525 . . . . 0.0 111.687 175.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -54.64 133.07 46.57 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.752 -178.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.462 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . 11.0 t-20 -103.97 128.4 27.29 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.658 -175.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 82' ' ' ASN . 17.3 Cg_exo -67.92 -36.25 18.46 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.01 2.474 . . . . 0.0 113.904 -177.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 33.0 ttp180 -96.13 -34.73 11.59 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.337 -0.545 . . . . 0.0 111.623 -176.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.443 ' HG2' ' CG ' ' A' ' 44' ' ' GLU . 95.8 mtt180 -93.14 25.4 3.3 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.301 0.572 . . . . 0.0 110.814 -172.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 86' ' ' VAL . 6.0 p -90.88 95.39 5.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.978 0.894 . . . . 0.0 109.619 173.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -86.25 73.36 10.21 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.291 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 25.5 m95 -66.75 166.64 12.73 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.499 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 1.025 ' HB3' ' HB2' ' A' ' 92' ' ' GLU . 6.2 t-80 -100.84 56.74 0.87 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.537 -172.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt 63.27 -86.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.826 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.465 ' O ' ' HD3' ' A' ' 93' ' ' PRO . 3.8 p-10 -103.82 5.57 36.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.384 -177.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 1.025 ' HB2' ' HB3' ' A' ' 89' ' ' HIS . 33.6 mt-10 -107.67 97.91 22.24 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.464 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 91' ' ' ASN . 88.2 Cg_endo -98.39 -150.76 0.03 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 123.58 2.853 . . . . 0.0 111.529 176.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -82.99 130.71 35.17 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.043 0.449 . . . . 0.0 110.231 175.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.465 HD21 ' HD2' ' A' ' 93' ' ' PRO . 30.9 m-80 -133.52 -152.21 0.48 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.23 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.487 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 22.9 t 68.29 -163.65 0.2 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.045 175.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.69 6.3 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.122 0.486 . . . . 0.0 110.794 -176.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 167.23 -44.51 0.25 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.831 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.793 ' HB3' ' H ' ' A' ' 118' ' ' CYS . 47.4 mt-10 -97.49 95.48 7.67 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 175.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.677 ' HB2' ' OD2' ' A' ' 115' ' ' ASP . 4.6 p-10 -131.29 25.76 4.84 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.111 0.482 . . . . 0.0 110.311 -176.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.72 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 93.2 m -46.86 131.21 11.99 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.142 -0.936 . . . . 0.0 112.077 -178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.84 ' HB ' ' HB3' ' A' ' 113' ' ' TRP . 10.4 m -80.14 144.17 11.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.582 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.647 HG11 ' HE1' ' A' ' 120' ' ' PHE . 28.0 m -130.62 150.01 34.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.787 170.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.562 ' HB2' HD21 ' A' ' 62' ' ' LEU . 14.7 tp -83.88 110.53 18.45 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 114' ' ' ASN . 11.1 p -134.46 152.31 33.39 Favored 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 -176.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.711 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 20.0 t80 -87.61 96.85 10.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.649 177.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.586 ' HB3' ' NE2' ' A' ' 89' ' ' HIS . 57.6 t30 -133.65 145.59 50.11 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 63.89 16.06 9.57 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.432 0.457 . . . . 0.0 110.414 -176.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.8 t70 78.0 19.55 1.07 Allowed 'General case' 0 N--CA 1.472 0.647 0 O-C-N 124.136 0.897 . . . . 0.0 111.624 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.444 ' HB3' ' HE3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -141.74 156.29 45.61 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.391 -0.818 . . . . 0.0 111.599 173.643 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.719 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 91.7 m95 -85.54 128.54 34.78 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.716 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.557 ' HB3' ' CD2' ' A' ' 89' ' ' HIS . . . -165.27 174.46 10.16 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.64 175.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.84 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 30.3 m0 -80.17 124.48 28.82 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.97 0.414 . . . . 0.0 111.165 -177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.423 ' HB2' ' CG1' ' A' ' 105' ' ' VAL . 8.0 t-20 -99.55 142.25 31.27 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.372 176.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.677 ' OD2' ' HB2' ' A' ' 100' ' ' ASN . 14.4 t70 -84.84 122.65 29.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.418 HG21 ' CE1' ' A' ' 120' ' ' PHE . 0.6 OUTLIER -151.27 149.04 23.66 Favored Pre-proline 0 C--N 1.331 -0.224 0 CA-C-O 120.837 0.351 . . . . 0.0 111.54 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.447 ' O ' ' HB3' ' A' ' 120' ' ' PHE . 8.2 Cg_endo -53.01 144.84 44.06 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.883 2.389 . . . . 0.0 111.52 172.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.793 ' H ' ' HB3' ' A' ' 99' ' ' GLU . 26.4 m -81.97 -14.41 56.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.576 -170.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -80.4 -8.95 59.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.0 110.459 174.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.647 ' HE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -74.07 133.62 42.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 170.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -112.73 146.26 39.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.471 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.451 ' O ' ' HA ' ' A' ' 21' ' ' ASN . . . -153.45 -168.6 3.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.365 -176.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 60' ' ' TYR . 8.5 t -69.35 166.66 18.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.696 HH11 ' HB2' ' A' ' 124' ' ' ARG . 0.0 OUTLIER -153.35 161.84 41.91 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -168.152 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.417 HD11 HD21 ' A' ' 54' ' ' LEU . 68.1 mt -136.55 133.94 49.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.101 179.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 75.8 m -102.6 142.25 34.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 173.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -121.81 136.01 54.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.852 0.358 . . . . 0.0 110.807 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.758 ' HB ' ' HB2' ' A' ' 14' ' ' CYS . 56.2 mt -125.23 135.28 26.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.754 177.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.19 157.21 29.94 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.065 1.843 . . . . 0.0 111.45 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.24 58.19 1.92 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.464 179.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 10.0 t -69.26 -20.9 63.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 111.568 0.211 . . . . 0.0 111.568 -176.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.6 m -66.09 -26.54 67.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.142 0.496 . . . . 0.0 110.617 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.441 ' N ' HD12 ' A' ' 133' ' ' LEU . 5.8 mp -90.32 -20.84 22.44 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.368 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.01 -28.46 22.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.429 0.633 . . . . 0.0 109.35 177.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -89.67 39.31 0.95 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.716 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -64.32 -49.56 71.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.851 -174.699 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -83.2 -26.8 30.5 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.011 0.434 . . . . 0.0 110.267 176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 58.1 mt -62.54 -52.59 62.85 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.601 178.289 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -75.05 -19.3 60.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.279 0.562 . . . . 0.0 110.057 -179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -63.02 -39.71 95.56 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -87.76 -44.53 11.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.271 175.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 64.5 m . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.46 -177.764 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.742 ' HG3' HG21 ' A' ' 132' ' ' THR . 63.6 ttp . . . . . 0 N--CA 1.481 1.106 0 CA-C-O 120.759 0.314 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.489 HG22 ' OG1' ' A' ' 132' ' ' THR . 17.0 m -98.48 119.59 46.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.675 0.75 . . . . 0.0 111.951 -179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.2 m -147.39 141.15 15.5 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 114.701 -1.136 . . . . 0.0 108.347 171.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.446 ' HB2' ' HD1' ' A' ' 7' ' ' TRP . 41.1 Cg_exo -57.27 149.15 66.28 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.489 2.126 . . . . 0.0 112.155 179.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.74 -14.84 18.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.403 0.621 . . . . 0.0 111.132 -176.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.7 -30.61 67.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.262 176.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.553 ' CD2' ' HB2' ' A' ' 16' ' ' PHE . 23.0 m95 -90.96 161.47 15.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.015 -173.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 14' ' ' CYS . 50.3 mmt-85 -115.7 136.19 53.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.931 177.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' ' O ' ' A' ' 13' ' ' ASN . . . -102.91 135.83 43.85 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.916 0.389 . . . . 0.0 111.579 -176.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.45 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . 73.6 t80 -137.97 110.18 7.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.621 175.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 66.0 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.209 -176.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 67.6 m -151.92 30.19 0.57 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.268 0.556 . . . . 0.0 109.759 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.471 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 17.7 m-80 -129.02 149.9 50.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.384 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 8' ' ' ARG . 85.5 m -124.89 127.14 46.63 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.074 0.464 . . . . 0.0 109.928 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.45 ' HE1' ' HB3' ' A' ' 10' ' ' PHE . 5.6 m-85 -117.0 141.59 48.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.194 -174.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.553 ' HB2' ' CD2' ' A' ' 7' ' ' TRP . 26.4 t80 -128.74 114.9 19.25 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-O 120.73 0.3 . . . . 0.0 110.367 175.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -88.79 138.41 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.784 0 C-N-CA 122.998 2.465 . . . . 0.0 112.23 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.45 ' HB2' ' HG3' ' A' ' 124' ' ' ARG . 5.1 mp -122.48 149.66 43.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.093 177.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 20' ' ' ASP . 2.6 p -101.16 66.29 1.12 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.886 -167.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.448 ' HA ' ' C ' ' A' ' 122' ' ' ALA . 32.0 t70 81.42 178.39 0.08 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.708 165.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 0.5 OUTLIER 86.57 15.23 0.11 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.569 1.147 . . . . 0.0 112.326 174.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.837 ' HD2' ' HB3' ' A' ' 26' ' ' GLU . 70.0 mmtt -139.28 148.23 42.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.95 0.405 . . . . 0.0 111.376 176.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 120' ' ' PHE . 44.6 p -85.17 172.2 11.39 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.478 ' HB3' ' HB3' ' A' ' 118' ' ' CYS . 75.4 t90 -62.16 -39.96 94.37 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 29' ' ' ARG . . . -57.09 -58.14 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.229 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.837 ' HB3' ' HD2' ' A' ' 22' ' ' LYS . 52.2 mm-40 -56.7 -37.75 71.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.538 179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.556 ' HB3' HD21 ' A' ' 38' ' ' LEU . 71.7 m -54.59 -50.73 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.538 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.442 ' HA ' ' HB2' ' A' ' 31' ' ' CYS . 9.0 tp10 -81.11 -21.66 39.71 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.737 0.303 . . . . 0.0 110.767 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 99.2 mtt180 -65.67 -42.98 90.67 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.074 0.464 . . . . 0.0 110.066 172.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -74.59 -28.22 60.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.226 178.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 28' ' ' GLU . 81.4 m -84.33 178.54 7.73 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.2 m 71.78 -45.66 0.62 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 122.67 0.388 . . . . 0.0 111.077 -174.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.96 -18.39 70.66 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 121.2 -0.524 . . . . 0.0 111.965 175.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 72.6 mtm -97.99 3.82 49.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.329 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 83.34 -0.9 89.45 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.89 -0.672 . . . . 0.0 111.891 -175.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HB2' ' HB ' ' A' ' 128' ' ' ILE . . . -100.36 -176.58 3.25 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.722 -0.239 . . . . 0.0 110.873 -178.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -149.31 165.09 33.02 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 27' ' ' SER . 33.2 mt -60.32 144.81 49.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.069 0.461 . . . . 0.0 111.442 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.431 ' CE ' HG12 ' A' ' 41' ' ' ILE . 0.5 OUTLIER -57.79 120.02 7.69 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.982 -175.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.535 ' CG2' ' HB3' ' A' ' 75' ' ' TRP . 53.9 p -116.86 101.91 8.94 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.646 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.431 HG12 ' CE ' ' A' ' 39' ' ' MET . 39.2 mt -64.8 109.2 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.212 -176.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 6.7 m -95.78 -37.83 10.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.462 -179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.9 p -125.66 154.09 42.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.545 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -68.39 -30.23 69.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.447 ' O ' ' HD2' ' A' ' 49' ' ' PHE . . . -61.38 -47.27 86.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.198 175.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -53.18 -47.35 68.9 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.277 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -60.82 -53.57 55.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.15 176.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -57.81 -31.02 66.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.433 -174.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.447 ' HD2' ' O ' ' A' ' 45' ' ' ALA . 34.1 m-85 -82.56 -39.24 22.56 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.507 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 10.7 tp -73.28 -32.22 36.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 120.576 -0.45 . . . . 0.0 111.35 -176.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.428 ' HB ' ' CD1' ' A' ' 111' ' ' TRP . 34.6 pt -69.34 -9.07 11.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.478 . . . . 0.0 111.234 -179.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -78.64 -27.42 45.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.161 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -91.51 -27.67 18.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.801 -179.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 50' ' ' ILE . 76.0 mt -68.95 134.32 49.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.663 -177.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.436 ' HB3' HD23 ' A' ' 58' ' ' LEU . 12.7 t70 -61.5 128.74 37.78 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 171.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.554 ' HA ' ' CZ2' ' A' ' 111' ' ' TRP . 64.9 mtt180 -85.48 32.02 0.58 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -168.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.855 ' HG2' HD22 ' A' ' 58' ' ' LEU . 2.0 ptp180 -127.03 -24.45 3.45 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.507 174.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.855 HD22 ' HG2' ' A' ' 57' ' ' ARG . 2.8 mm? -86.31 162.3 18.3 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.277 0.561 . . . . 0.0 112.074 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.434 ' HB2' HG21 ' A' ' 103' ' ' VAL . 4.6 p -112.55 112.74 24.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.792 174.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.566 ' HB3' HG13 ' A' ' 125' ' ' ILE . 62.7 m-85 -99.36 120.74 40.07 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.715 ' HA ' HG12 ' A' ' 103' ' ' VAL . 24.3 m-85 -59.12 128.99 39.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.071 0.462 . . . . 0.0 111.734 177.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.821 HD11 ' HG ' ' A' ' 104' ' ' LEU . 98.9 mt -103.53 157.43 17.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.194 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.604 ' O ' ' HA ' ' A' ' 75' ' ' TRP . . . -78.98 39.39 2.03 Favored Glycine 0 C--O 1.223 -0.591 0 C-N-CA 120.544 -0.836 . . . . 0.0 113.333 -176.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.642 ' HB3' HG22 ' A' ' 102' ' ' VAL . 33.2 tp -105.04 116.35 31.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.414 0.607 . . . . 0.0 109.621 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.3 ttt85 -115.03 127.73 55.83 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -172.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -122.91 107.37 11.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 167.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.695 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 36.4 tt0 -99.71 118.73 36.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.679 -172.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.0 m120 69.0 21.5 7.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.431 175.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . 57.94 70.07 0.68 Allowed 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.687 -176.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.695 ' HG3' ' O ' ' A' ' 67' ' ' GLU . 61.1 mttp -91.59 -16.77 26.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.949 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 74.77 12.63 82.8 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 110.612 -0.995 . . . . 0.0 110.612 -175.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -109.43 74.99 0.92 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.058 -0.571 . . . . 0.0 109.656 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.641 ' O ' ' HB2' ' A' ' 81' ' ' PHE . 91.7 m95 -66.68 104.23 1.26 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 178.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -123.68 144.62 49.53 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 -174.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TRP . . . . . 0.604 ' HA ' ' O ' ' A' ' 63' ' ' GLY . 89.8 m95 -85.99 131.66 34.23 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.058 178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.1 p -57.82 -27.92 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.989 -175.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.515 ' HB3' HG21 ' A' ' 40' ' ' THR . 2.3 t70 -55.92 -62.43 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.039 173.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.437 ' HB2' ' O ' ' A' ' 77' ' ' ASP . 21.8 tm0? 163.44 -29.89 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 -177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 75' ' ' TRP . 3.6 m -42.08 121.74 2.48 Favored Pre-proline 0 C--O 1.235 0.333 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.09 -178.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 79' ' ' THR . 23.7 Cg_exo -66.96 161.28 43.2 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.647 2.231 . . . . 0.0 111.385 173.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.641 ' HB2' ' O ' ' A' ' 73' ' ' TRP . 56.5 t80 -69.02 142.46 54.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.833 -178.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.481 ' HB3' ' HB2' ' A' ' 85' ' ' ARG . 45.0 m-80 -103.1 96.84 8.61 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.305 176.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 81' ' ' PHE . 17.7 Cg_exo -67.33 -29.85 37.75 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.519 2.146 . . . . 0.0 111.539 179.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -81.04 -11.66 59.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.629 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.481 ' HB2' ' HB3' ' A' ' 82' ' ' ASN . 92.2 mtt180 -129.44 55.51 1.76 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.176 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.5 p -101.73 138.06 27.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.924 179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -130.77 71.6 1.47 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.298 -177.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -75.84 168.95 19.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.165 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.799 ' HB3' ' HB2' ' A' ' 92' ' ' GLU . 3.9 m-70 -95.02 106.59 18.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.024 173.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.464 ' HG2' ' OD1' ' A' ' 91' ' ' ASN . 88.1 tttt -62.87 130.04 43.08 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.669 -178.274 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.464 ' OD1' ' HG2' ' A' ' 90' ' ' LYS . 23.4 m120 70.09 16.44 7.49 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.275 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.799 ' HB2' ' HB3' ' A' ' 89' ' ' HIS . 35.4 mt-10 -125.44 121.69 24.89 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.193 172.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.03 115.83 3.35 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.498 2.132 . . . . 0.0 111.985 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.555 ' OD1' ' HA ' ' A' ' 114' ' ' ASN . 63.7 m-20 -110.95 81.32 1.41 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.623 179.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 94' ' ' ASP . 3.7 t-20 176.73 101.78 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.976 177.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.791 ' HB2' ' HB3' ' A' ' 100' ' ' ASN . 15.6 m -86.42 15.08 5.74 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -176.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 45.35 25.83 0.24 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.791 1.237 . . . . 0.0 113.825 175.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -137.08 -143.16 4.53 Favored Glycine 0 CA--C 1.505 -0.553 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 177.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.597 ' HA ' ' HA ' ' A' ' 67' ' ' GLU . 9.4 pt-20 -88.75 86.17 6.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 118.498 1.149 . . . . 0.0 108.186 168.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.791 ' HB3' ' HB2' ' A' ' 96' ' ' SER . 1.3 p-10 -109.43 163.06 13.76 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.466 -1.243 . . . . 0.0 111.314 -172.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.11 148.24 28.06 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.955 -1.02 . . . . 0.0 110.306 -175.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' A' ' 64' ' ' LEU . 20.9 m -88.56 147.21 5.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.209 0.528 . . . . 0.0 111.344 -176.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.715 HG12 ' HA ' ' A' ' 61' ' ' PHE . 34.5 m -118.59 152.76 20.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.411 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.821 ' HG ' HD11 ' A' ' 62' ' ' LEU . 17.4 mt -83.09 103.41 12.5 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.2 p -123.01 138.34 53.38 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.488 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -87.71 96.52 10.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.478 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.47 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 62.2 t30 -140.88 147.17 38.49 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 64.4 24.25 13.15 Favored 'General case' 0 C--O 1.235 0.305 0 O-C-N 123.648 0.593 . . . . 0.0 109.705 -172.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 66.59 22.6 10.5 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.315 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -134.41 151.31 51.11 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 121.969 -0.457 . . . . 0.0 111.199 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.554 ' CZ2' ' HA ' ' A' ' 56' ' ' ARG . 81.9 m95 -88.71 108.6 19.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.509 171.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -143.45 165.76 26.67 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.93 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.582 ' HB3' ' HB ' ' A' ' 102' ' ' VAL . 44.3 m0 -78.0 125.67 29.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.39 -177.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.555 ' HA ' ' OD1' ' A' ' 94' ' ' ASP . 2.7 t-20 -121.99 125.7 46.9 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 172.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 20.0 t70 -84.17 128.08 34.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.213 0.53 . . . . 0.0 111.744 -173.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.6 m -138.59 159.03 69.21 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.552 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.57 ' HG2' ' HB2' ' A' ' 120' ' ' PHE . 10.4 Cg_endo -55.85 137.93 80.23 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.384 2.056 . . . . 0.0 111.929 176.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.478 ' HB3' ' HB3' ' A' ' 24' ' ' TRP . 90.1 m -69.74 -9.1 53.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.042 0.448 . . . . 0.0 111.676 -178.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -98.85 13.24 33.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.627 176.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.57 ' HB2' ' HG2' ' A' ' 117' ' ' PRO . 61.9 t80 -89.08 140.36 29.53 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.611 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -82.57 125.13 30.81 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 177.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.569 ' HB3' ' CE2' ' A' ' 61' ' ' PHE . . . -157.49 -167.25 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.044 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.416 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 20.0 m -84.46 175.04 9.58 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . 0.45 ' HG3' ' HB2' ' A' ' 18' ' ' LEU . 1.1 ptm180 -154.83 155.43 34.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.761 0.315 . . . . 0.0 111.733 -173.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.566 HG13 ' HB3' ' A' ' 60' ' ' TYR . 38.2 mt -127.9 123.82 61.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 4.9 t -106.53 134.84 49.05 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -119.09 125.76 50.05 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.829 0.347 . . . . 0.0 110.94 -177.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.445 ' CG2' ' HB2' ' A' ' 14' ' ' CYS . 11.0 tt -112.08 141.39 24.86 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -68.51 146.5 68.18 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 121.886 1.724 . . . . 0.0 111.029 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -73.54 63.12 1.87 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.712 176.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 9.0 t -80.92 22.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.813 0.816 . . . . 0.0 110.946 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.742 HG21 ' HG3' ' A' ' 1' ' ' MET . 5.9 t -66.99 -11.25 56.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.385 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.793 HD23 ' H ' ' A' ' 133' ' ' LEU . 1.9 pt? -74.38 -41.35 61.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.333 0.587 . . . . 0.0 109.989 176.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . 0.415 ' N ' ' HG ' ' A' ' 133' ' ' LEU . 9.8 t30 -87.83 -46.77 9.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.869 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -90.02 21.0 3.89 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 132' ' ' THR . 0.0 OUTLIER -58.58 -59.32 5.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.815 0.34 . . . . 0.0 111.313 -179.738 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 141' ' ' GLN . 6.5 p30 -71.86 -26.69 62.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.122 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.95 -48.32 76.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 178.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -70.99 -25.58 62.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.146 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -70.32 -39.66 74.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.866 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 137' ' ' ASN . 85.6 mm-40 -75.11 -7.37 53.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.366 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.669 177.582 . . . . . . . . 0 0 . 1 stop_ save_