data_1lmm_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 1lmm _Structure_validation_residue.Date_analyzed 2016-10-06 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 . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.998 0.428 . . . . 1.0 110.989 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.428 ' CD1' ' N ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER -70.08 121.11 81.93 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.102 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.96 141.22 93.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.22 1.947 . . . . 1.0 111.706 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 pttm -71.69 154.19 41.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.908 0.385 . . . . 1.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 20.5 m95 56.04 28.77 13.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.027 -0.533 . . . . 1.0 111.311 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 2.0 tptt -109.85 152.59 25.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.417 . . . . 1.0 110.754 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.69 162.83 0.05 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.219 -0.515 . . . . 1.0 113.214 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.15 -8.58 35.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.547 0.213 . . . . 1.0 111.498 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 22.0 t -41.19 159.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.473 -0.33 . . . . 1.0 111.413 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.47 ' HB3' ' O ' ' A' ' 11' ' ' VAL . 56.8 t-20 75.2 83.36 0.1 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.979 0.418 . . . . 1.0 110.285 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 21.9 mmt-85 83.21 -16.71 0.55 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.482 -0.781 . . . . 1.0 112.07 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.61 87.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.796 0.332 . . . . 1.0 111.276 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.03 34.46 2.76 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.664 -0.779 . . . . 1.0 112.536 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.95 24.89 7.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.652 0.263 . . . . 1.0 111.048 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.407 ' HB3' HD13 ' A' ' 21' ' ' LEU . 35.2 m -42.91 150.45 0.16 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.056 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.2 t -70.13 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.91 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.89 -154.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.231 -0.285 . . . . 1.0 110.231 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.55 28.46 2.08 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.753 -0.736 . . . . 1.0 112.941 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -69.77 144.19 52.76 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.715 0.293 . . . . 1.0 110.624 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -106.65 137.15 45.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 1.0 111.002 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.95 112.4 20.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.992 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -95.1 122.13 37.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.915 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.41 ' CA ' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -84.8 133.86 34.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.871 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.64 -159.69 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.591 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -51.47 52.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.348 -0.387 . . . . 1.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.52 -43.11 1.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.905 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 p -57.53 177.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.15 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.401 ' CD1' ' N ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -66.04 -167.14 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.463 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.41 ' HB3' ' CA ' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -111.04 161.32 16.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.403 179.615 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.0 m -131.74 127.66 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 1.0 111.179 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.6 m -61.73 127.4 31.24 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.768 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.6 m -124.68 115.04 26.83 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.759 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.16 134.52 59.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.622 2.215 . . . . 1.0 112.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.993 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.556 -0.293 . . . . 1.0 110.598 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.754 0.312 . . . . 1.0 111.282 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -70.34 147.66 95.25 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.721 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 1.7 Cg_endo -79.83 119.6 4.04 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.563 2.175 . . . . 1.0 111.461 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.43 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.89 145.23 46.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.896 0.379 . . . . 1.0 111.009 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.43 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 9.4 m95 59.7 49.21 8.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.997 -0.547 . . . . 1.0 111.501 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -141.89 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.868 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.48 145.36 1.34 Allowed Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.005 -0.543 . . . . 1.0 113.191 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -95.66 0.76 53.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.386 0.143 . . . . 1.0 111.386 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.58 86.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 120.977 0.418 . . . . 1.0 111.559 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.1 t-20 175.41 81.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.415 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 mmt-85 68.57 10.58 7.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.19 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 45.98 71.19 0.31 Allowed 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.899 0.381 . . . . 1.0 111.445 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 123.95 40.75 0.44 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.62 -0.8 . . . . 1.0 113.012 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 5.1 m-20 -100.46 23.02 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.427 0.156 . . . . 1.0 110.931 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 29.8 m -47.25 151.83 0.66 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.642 -0.254 . . . . 1.0 110.889 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.81 -97.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.15 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.42 ' HG3' ' CG ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.87 -155.03 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.214 -0.291 . . . . 1.0 110.214 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.88 31.37 0.75 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.651 -0.785 . . . . 1.0 114.346 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.435 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -78.16 147.14 34.67 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 117.591 0.696 . . . . 1.0 110.603 179.358 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -102.85 150.82 23.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.0 t -91.19 112.41 24.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.0 m0 -105.68 163.66 12.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.988 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -116.68 151.71 35.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.911 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.41 126.09 53.08 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.591 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -38.67 4.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.946 -0.57 . . . . 1.0 111.074 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.78 -68.11 0.83 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.902 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.58 176.19 3.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -70.25 -152.67 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.913 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.56 160.35 14.55 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 120.664 0.268 . . . . 1.0 110.687 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.8 t -155.93 140.33 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.461 -0.336 . . . . 1.0 111.278 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 20.3 m -75.05 139.01 42.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.257 -0.429 . . . . 1.0 110.513 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.0 m -128.29 120.92 21.28 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-O 120.491 0.186 . . . . 1.0 111.284 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -61.34 141.86 94.02 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.04 2.494 . . . . 1.0 112.325 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -48.73 -76.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.889 179.888 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.617 0.246 . . . . 1.0 111.224 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.411 ' CG2' ' HA ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -70.11 125.13 91.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.529 -0.305 . . . . 1.0 111.255 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.13 124.39 14.29 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.492 2.128 . . . . 1.0 112.119 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.477 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.88 -170.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.03 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.477 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 31.5 p-90 43.09 47.6 5.19 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.301 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.404 ' CD ' ' C ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -134.13 158.55 43.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.584 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.402 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -77.15 143.61 28.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.686 -0.769 . . . . 1.0 112.255 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.2 p -116.14 34.39 5.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.799 0.333 . . . . 1.0 111.31 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.428 HG23 ' CD2' ' A' ' 30' ' ' PHE . 19.0 t -54.56 128.23 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.329 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 59.5 18.92 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.279 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -149.66 66.2 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.256 0.55 . . . . 1.0 110.801 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.73 50.32 0.83 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.674 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 171.66 33.01 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.783 -0.723 . . . . 1.0 113.045 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.42 4.45 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.517 0.199 . . . . 1.0 110.628 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' CG2' ' A' ' 4' ' ' ILE . 86.6 m -70.34 148.52 48.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.788 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -69.96 -93.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.366 -0.379 . . . . 1.0 110.897 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.41 -159.6 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.6 0.238 . . . . 1.0 110.747 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.29 41.38 2.46 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.587 -0.816 . . . . 1.0 112.751 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mp -69.84 164.84 22.81 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 120.972 0.415 . . . . 1.0 111.389 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.24 134.01 39.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.661 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.18 107.36 9.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.942 0.401 . . . . 1.0 110.82 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -93.45 126.12 38.42 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.292 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -74.17 136.98 42.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.467 . . . . 1.0 110.812 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -91.21 -162.97 0.97 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.584 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -70.03 -66.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 1.0 110.904 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.21 -52.37 2.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.79 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.88 171.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.962 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.428 ' CD2' HG23 ' A' ' 11' ' ' VAL . 1.3 t80 -68.6 -157.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.761 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 5.4 pt-20 -102.3 138.41 39.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 1.0 110.909 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.1 m -109.6 135.17 49.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.113 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 14.2 t -59.72 135.85 57.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.093 -0.503 . . . . 1.0 111.414 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.4 p -143.05 132.91 11.97 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-O 120.715 0.293 . . . . 1.0 111.363 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -59.97 140.14 91.34 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.922 2.414 . . . . 1.0 112.576 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -66.37 -47.04 74.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.988 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.89 -0.595 . . . . 1.0 110.939 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.72 0.295 . . . . 1.0 111.061 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -70.05 147.37 95.69 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 1.0 111.216 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -64.11 130.7 28.05 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.622 2.215 . . . . 1.0 111.955 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.17 149.86 27.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 1.0 110.661 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER 63.11 36.42 12.22 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.836 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -101.19 149.95 23.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.477 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.499 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -45.58 173.83 0.01 OUTLIER Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.3 -0.476 . . . . 1.0 113.531 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.427 ' O ' ' N ' ' A' ' 12' ' ' ASN . 19.3 t -104.45 -12.63 16.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.585 0.231 . . . . 1.0 111.424 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.97 82.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.993 0.425 . . . . 1.0 111.206 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 10' ' ' CYS . 6.0 t-20 177.46 75.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.473 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 65.51 14.99 9.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.421 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 48.28 84.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.786 0.327 . . . . 1.0 111.334 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 109.37 53.31 0.6 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.58 -0.819 . . . . 1.0 112.517 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -111.43 20.73 16.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.562 0.22 . . . . 1.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.404 ' HA ' HG12 ' A' ' 4' ' ' ILE . 4.2 m -61.9 163.71 7.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.514 -0.312 . . . . 1.0 110.444 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.6 t -55.35 -94.71 0.0 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.77 -0.195 . . . . 1.0 110.798 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -66.64 -154.94 0.01 OUTLIER 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.1 -0.333 . . . . 1.0 110.1 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.49 33.27 1.59 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 1.0 113.001 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.71 151.47 45.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.93 0.365 . . . . 1.0 111.138 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -118.67 134.48 55.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.165 0.507 . . . . 1.0 110.291 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 14.6 p -79.1 126.9 31.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 33.0 m0 -108.78 135.99 49.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.011 -0.54 . . . . 1.0 111.203 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.5 tptm -90.1 134.65 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.458 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 174.93 5.67 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.084 0.468 . . . . 1.0 110.673 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -73.05 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.804 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -71.01 -66.98 0.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.548 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 p -69.28 152.14 45.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.213 -0.448 . . . . 1.0 110.714 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -147.11 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.731 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 8.5 mt-10 -89.92 169.44 11.23 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.841 0.353 . . . . 1.0 110.756 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.71 139.9 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 33.8 m -69.97 140.37 52.97 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.176 -0.466 . . . . 1.0 111.059 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.2 p -143.2 138.24 15.48 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.674 -0.239 . . . . 1.0 111.095 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -58.16 139.92 92.28 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.927 2.418 . . . . 1.0 112.747 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -51.18 -39.05 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 1.0 110.974 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.532 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 8.8 t . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 115.901 -0.591 . . . . 1.0 110.719 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 2.4 m . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.702 -0.111 . . . . 1.0 110.702 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.46 HG21 ' HA ' ' A' ' 17' ' ' CYS . 11.0 tt -70.63 140.98 87.22 Favored Pre-proline 0 N--CA 1.455 -0.183 0 O-C-N 122.393 -0.192 . . . . 1.0 110.798 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 44.3 Cg_exo -54.19 113.18 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.085 1.857 . . . . 1.0 111.828 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.23 145.67 46.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.875 0.369 . . . . 1.0 110.806 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.8 m0 67.68 19.35 9.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.805 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 5' ' ' PRO . 0.4 OUTLIER -110.23 173.8 6.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.729 0.299 . . . . 1.0 110.806 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.3 150.94 28.68 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.836 -0.697 . . . . 1.0 112.63 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 12' ' ' ASN . 21.0 p -115.1 19.06 15.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.475 0.179 . . . . 1.0 111.311 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.47 82.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.85 0.357 . . . . 1.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 10' ' ' CYS . 4.6 t-20 177.59 81.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.568 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.408 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 73.84 5.47 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.742 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.23 83.63 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 120.888 0.375 . . . . 1.0 111.33 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.08 34.41 0.89 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.596 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.64 22.03 13.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.664 0.269 . . . . 1.0 110.858 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.46 ' HA ' HG21 ' A' ' 4' ' ' ILE . 11.6 m -58.41 165.59 2.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 1.0 110.674 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 39.5 t -70.24 -88.57 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.387 -0.369 . . . . 1.0 111.915 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -67.88 66.47 0.1 Allowed 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.879 0.371 . . . . 1.0 111.702 -178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 39.97 26.64 0.1 Allowed Glycine 0 C--O 1.225 -0.433 0 C-N-CA 121.228 -0.511 . . . . 1.0 113.817 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.27 151.16 46.6 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 120.983 0.42 . . . . 1.0 110.576 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -101.54 159.03 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 1.0 110.774 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.8 t -98.51 120.25 38.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.921 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -109.69 130.98 55.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.78 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.69 148.29 25.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.7 mmt-85 -114.03 129.51 56.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.643 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.13 -30.39 1.12 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.448 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 -82.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.63 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.6 p -70.14 -177.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.915 0.388 . . . . 1.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -153.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.662 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -113.32 136.83 52.33 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.806 0.336 . . . . 1.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.7 m -126.04 163.99 26.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.302 -0.408 . . . . 1.0 111.374 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.3 m -69.23 161.07 29.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.738 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.9 p -170.33 138.16 1.36 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.382 -0.372 . . . . 1.0 110.938 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -53.85 136.04 64.8 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.004 2.469 . . . . 1.0 112.554 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -89.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.326 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.188 0 O-C-N 122.397 -0.19 . . . . 1.0 110.926 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.597 0.237 . . . . 1.0 110.776 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 pp -70.1 141.76 89.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.229 . . . . 1.0 111.207 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -68.45 140.24 47.43 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.534 2.156 . . . . 1.0 111.95 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -71.72 162.95 28.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 24.3 m0 60.14 31.48 20.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.024 -0.535 . . . . 1.0 111.271 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -120.06 147.72 44.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.517 179.867 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -71.07 136.68 25.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.059 -0.591 . . . . 1.0 112.845 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -94.32 27.45 2.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.689 0.281 . . . . 1.0 111.009 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.6 70.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 1.0 110.987 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -177.22 -70.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.442 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 7.5 mmm180 -95.84 -9.49 31.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.342 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 53.63 92.41 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-O 121.087 0.47 . . . . 1.0 110.832 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.72 48.81 4.81 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.238 -179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.464 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 0.0 OUTLIER -88.08 5.27 41.9 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.515 -0.342 . . . . 1.0 111.204 -179.113 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 21' ' ' LEU . 57.3 m -45.69 138.8 4.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.946 0.403 . . . . 1.0 111.779 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 t -70.4 -83.31 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.377 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.79 -153.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.608 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 17.98 3.34 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.625 -0.797 . . . . 1.0 113.173 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -69.69 144.3 52.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.098 0.449 . . . . 1.0 110.525 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.07 160.01 20.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 1.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -91.61 109.71 21.02 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.85 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 36.9 m0 -115.64 149.54 38.16 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.29 -0.413 . . . . 1.0 111.291 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -70.7 128.4 35.94 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.006 -0.543 . . . . 1.0 110.93 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.416 ' HD2' ' CG2' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.88 -162.61 0.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.563 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -68.12 0.44 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.794 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 ttp-105 -103.89 -43.08 5.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.9 p -67.73 157.37 34.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.996 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -158.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.433 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 44.0 mt-10 -80.26 124.56 28.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 120.978 0.418 . . . . 1.0 110.887 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.416 ' CG2' ' HD2' ' A' ' 26' ' ' ARG . 34.7 m -117.3 160.99 16.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 1.0 111.048 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 5.0 m -69.51 142.41 53.69 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.284 -0.416 . . . . 1.0 111.131 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.34 120.16 7.37 Favored Pre-proline 0 C--N 1.323 -0.557 0 C-N-CA 122.195 0.198 . . . . 1.0 111.073 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.94 139.08 89.13 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.858 2.372 . . . . 1.0 112.475 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.94 -35.83 2.18 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.116 -0.493 . . . . 1.0 111.137 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.8 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.639 179.876 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.571 0.224 . . . . 1.0 111.077 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.03 142.33 90.29 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.188 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.17 124.88 15.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.512 2.141 . . . . 1.0 111.983 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -70.16 150.38 46.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 7' ' ' TRP . 2.0 m0 67.33 27.27 8.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 1.0 111.184 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.04 169.05 9.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.426 -0.352 . . . . 1.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 152.15 46.48 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.662 -0.78 . . . . 1.0 112.569 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.91 5.48 49.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.407 0.151 . . . . 1.0 111.407 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.5 p -70.93 65.41 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.085 0.469 . . . . 1.0 110.861 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -177.32 -54.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.871 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.41 ' HB3' ' CB ' ' A' ' 16' ' ' ASP . 1.0 OUTLIER -97.91 -38.28 9.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.814 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.26 84.88 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.049 -0.523 . . . . 1.0 111.448 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.13 -0.88 71.86 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.742 -0.742 . . . . 1.0 113.259 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.41 ' CB ' ' HB3' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -98.14 24.13 7.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.985 0.421 . . . . 1.0 110.65 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 172.63 0.03 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.035 -0.53 . . . . 1.0 111.052 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.6 t -64.62 -96.7 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.533 -0.303 . . . . 1.0 111.164 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.43 ' C ' ' H ' ' A' ' 21' ' ' LEU . 3.2 mm-40 -65.78 -164.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 N-CA-C 110.202 -0.296 . . . . 1.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.28 39.53 0.86 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.646 -0.788 . . . . 1.0 112.779 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.4 OUTLIER -69.82 155.14 40.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 120.819 0.343 . . . . 1.0 111.157 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.98 135.81 50.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.598 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.5 m -74.78 127.59 33.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.009 -0.541 . . . . 1.0 111.134 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -119.28 133.95 55.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.877 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -83.14 148.07 27.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.768 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.835 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -76.16 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.133 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.44 -59.45 2.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.464 . . . . 1.0 110.923 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.58 162.25 3.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.736 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -82.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.792 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -159.53 144.38 15.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 1.0 111.073 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.9 m -125.94 143.23 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.287 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 148.92 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.249 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.2 m -147.46 132.87 9.21 Favored Pre-proline 0 C--N 1.323 -0.562 0 C-N-CA 122.401 0.281 . . . . 1.0 111.245 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -57.27 136.37 75.9 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.875 2.383 . . . . 1.0 112.685 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -68.96 -45.7 70.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.02 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.446 -179.93 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.522 -0.118 0 CA-C-O 120.768 0.318 . . . . 1.0 111.307 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.421 HG22 ' HA ' ' A' ' 17' ' ' CYS . 8.0 tp -70.18 116.38 43.99 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 111.291 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.48 117.59 4.33 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.391 2.061 . . . . 1.0 111.885 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.62 169.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.18 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 25.4 m95 61.82 38.15 14.97 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.075 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.25 164.34 30.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.78 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.73 136.22 47.71 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.757 -0.735 . . . . 1.0 112.539 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.4 p -117.36 21.83 12.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.654 0.264 . . . . 1.0 111.275 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.05 87.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.901 0.381 . . . . 1.0 111.101 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -176.84 78.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 70.75 5.18 5.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.83 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 44.24 83.04 0.03 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.015 0.436 . . . . 1.0 111.412 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.25 10.29 1.96 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.67 -0.776 . . . . 1.0 113.143 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.89 11.84 23.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.226 0.513 . . . . 1.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.421 ' HA ' HG22 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -57.76 179.63 0.06 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 1.0 110.891 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.8 t -68.99 -95.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.692 -0.231 . . . . 1.0 111.036 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 -155.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.212 -0.292 . . . . 1.0 110.212 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.76 34.71 2.31 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.725 -0.75 . . . . 1.0 112.784 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 152.77 44.46 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 120.781 0.324 . . . . 1.0 111.023 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -116.85 158.39 24.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.917 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.0 m -86.69 113.85 22.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.902 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.441 ' CG ' HG12 ' A' ' 34' ' ' VAL . 18.8 m0 -108.4 136.4 48.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.822 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -88.18 150.85 23.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.037 0.446 . . . . 1.0 110.948 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -110.39 122.58 48.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.679 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -46.31 -40.5 11.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.275 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -92.51 -75.94 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -176.11 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.153 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -149.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 1.0 110.728 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.33 176.1 7.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.764 0.316 . . . . 1.0 110.677 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -170.11 144.81 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.451 -0.341 . . . . 1.0 111.388 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 153.63 40.03 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.96 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.441 HG12 ' CG ' ' A' ' 24' ' ' TRP . 7.1 p -146.53 137.23 12.48 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 116.727 -0.215 . . . . 1.0 111.547 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.36 145.79 97.91 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.953 2.435 . . . . 1.0 112.464 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -131.54 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.331 -0.395 . . . . 1.0 110.48 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 68.5 m . . . . . 0 C--N 1.332 -0.187 0 CA-C-O 120.614 0.245 . . . . 1.0 110.878 179.894 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.619 0.247 . . . . 1.0 111.178 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.6 pp -58.15 161.23 7.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.515 -0.311 . . . . 1.0 111.375 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -81.97 112.16 2.29 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.019 2.479 . . . . 1.0 111.774 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 pttt -58.3 155.48 11.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.918 0.389 . . . . 1.0 111.163 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.4 m95 60.38 43.38 13.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.349 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -142.6 170.16 16.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.838 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.94 162.85 6.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.77 -0.729 . . . . 1.0 112.607 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.407 ' O ' ' N ' ' A' ' 12' ' ' ASN . 3.2 m -127.03 19.23 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.426 0.155 . . . . 1.0 111.302 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 t -57.42 85.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.78 0.324 . . . . 1.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 10' ' ' CYS . 30.4 t-20 179.76 80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 1.0 110.526 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 68.28 13.59 9.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.264 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.94 37.1 4.55 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.406 -0.361 . . . . 1.0 111.455 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 174.15 37.23 0.04 OUTLIER Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.999 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.8 15.04 29.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.531 0.205 . . . . 1.0 110.962 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.12 174.86 4.99 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.587 -0.278 . . . . 1.0 110.655 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.401 ' HB3' HD11 ' A' ' 21' ' ' LEU . 51.3 t -70.03 -105.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.753 -0.203 . . . . 1.0 111.045 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.23 -161.47 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.163 -0.31 . . . . 1.0 110.163 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.48 39.41 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.413 -0.899 . . . . 1.0 112.87 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 18' ' ' CYS . 0.2 OUTLIER -70.01 147.95 49.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.823 0.344 . . . . 1.0 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.03 153.56 32.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.003 0.43 . . . . 1.0 110.647 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.19 114.37 26.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.282 -0.417 . . . . 1.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -103.47 129.8 50.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.075 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -84.64 134.66 34.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.704 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -163.55 0.85 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.353 . . . . 1.0 110.641 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -79.7 0.06 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.636 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.47 -39.25 10.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.593 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.97 167.99 4.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.846 -0.616 . . . . 1.0 111.024 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -156.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -107.35 155.08 20.39 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.828 0.346 . . . . 1.0 110.721 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.18 138.57 33.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.315 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.65 155.26 16.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.9 p -155.28 116.72 2.36 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.024 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.0 137.76 77.89 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.764 2.309 . . . . 1.0 112.596 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.2 -67.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.907 -0.588 . . . . 1.0 111.436 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.543 -0.298 . . . . 1.0 111.075 179.994 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 120.603 0.24 . . . . 1.0 111.433 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -70.1 144.7 93.0 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.402 -0.363 . . . . 1.0 111.287 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -55.11 140.71 80.65 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.382 2.055 . . . . 1.0 112.052 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 18.0 pttt -96.02 30.81 2.3 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.996 0.427 . . . . 1.0 111.198 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 8.6 m95 -148.21 29.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.754 -0.657 . . . . 1.0 110.737 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.9 mmtm -118.68 161.69 19.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.385 . . . . 1.0 110.999 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' A' ' 31' ' ' GLU . . . -54.71 -179.16 0.18 Allowed Glycine 0 C--N 1.329 0.163 0 C-N-CA 121.053 -0.594 . . . . 1.0 112.434 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -131.86 11.03 4.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 111.607 0.225 . . . . 1.0 111.607 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.44 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 13.0 p -77.32 55.07 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.949 0.404 . . . . 1.0 111.092 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 51.5 t-20 172.96 -36.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.111 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mmt-85 -81.46 -52.18 7.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.779 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 51.43 67.05 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.121 0.486 . . . . 1.0 110.937 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.55 26.08 66.3 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.813 -0.708 . . . . 1.0 112.271 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.77 23.43 11.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.619 0.247 . . . . 1.0 110.919 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 21' ' ' LEU . 3.5 m -58.65 167.56 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 1.0 110.388 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -60.31 -85.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.531 -179.775 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.432 ' N ' ' SG ' ' A' ' 18' ' ' CYS . 22.9 mt-10 -70.34 -161.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.06 37.76 1.32 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.373 -0.918 . . . . 1.0 112.342 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -70.0 154.2 42.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.069 0.461 . . . . 1.0 110.95 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HG3' ' CD1' ' A' ' 24' ' ' TRP . 0.5 OUTLIER -109.72 149.86 29.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.315 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.25 98.74 9.97 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 1.0 110.537 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.506 ' CD1' ' HG3' ' A' ' 22' ' ' GLU . 42.6 m0 -76.74 133.55 39.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 1.0 111.131 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -84.56 165.82 17.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.777 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 148.79 35.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.696 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -56.12 -54.57 43.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.995 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 mtp85 -70.32 -80.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 1.0 110.624 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 p -70.12 163.04 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.765 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CZ ' HG13 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -57.59 -80.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.657 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.41 ' O ' ' HA2' ' A' ' 9' ' ' GLY . 18.2 mt-10 -154.82 -167.97 2.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.743 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.3 p -170.28 142.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 1.0 111.027 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.8 m -67.01 159.99 27.47 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.502 -0.317 . . . . 1.0 110.621 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.418 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.7 p -173.18 137.55 0.77 Allowed Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 111.613 0.227 . . . . 1.0 111.613 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.01 140.86 97.23 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.955 2.437 . . . . 1.0 112.418 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -60.34 -78.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 80.0 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.347 -0.388 . . . . 1.0 110.792 179.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.71 0.29 . . . . 1.0 110.756 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.591 HG21 ' HA ' ' A' ' 17' ' ' CYS . 0.5 OUTLIER -70.14 117.6 55.85 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.081 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.8 171.78 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.633 2.222 . . . . 1.0 112.852 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 34.0 pttt -87.39 50.45 2.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.927 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.441 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.0 m95 -147.99 29.32 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.433 -0.349 . . . . 1.0 111.1 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 tmtm? -116.69 137.98 51.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.27 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.18 144.87 9.93 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.997 -0.62 . . . . 1.0 112.671 -179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 p -109.99 7.34 23.67 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.755 0.28 . . . . 1.0 111.755 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.432 HG23 ' CE2' ' A' ' 30' ' ' PHE . 34.8 t -61.95 138.22 22.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.538 0.209 . . . . 1.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.1 t-20 68.88 84.53 0.15 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.207 0.527 . . . . 1.0 109.629 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 1.2 mmm180 76.39 82.32 0.09 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.075 -0.966 . . . . 1.0 109.845 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -67.48 49.74 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.986 -1.006 . . . . 1.0 111.897 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -160.66 22.26 0.24 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 121.169 -0.539 . . . . 1.0 112.356 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -6.86 59.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.616 0.246 . . . . 1.0 110.982 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.613 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 2.9 t -69.73 -159.81 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.788 -0.449 . . . . 1.0 109.788 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.469 ' N ' ' CG2' ' A' ' 4' ' ' ILE . 42.3 t -70.31 -105.29 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.15 0.426 . . . . 1.0 112.15 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.566 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -70.43 -160.46 0.04 OUTLIER 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.566 0.222 . . . . 1.0 110.851 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.18 47.67 2.66 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.313 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.613 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -69.4 144.15 53.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.915 0.388 . . . . 1.0 110.763 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.5 165.68 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.232 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.27 107.2 17.7 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.851 -0.613 . . . . 1.0 110.571 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -102.22 126.97 49.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.83 145.05 29.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.619 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -107.02 123.08 47.68 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -46.31 -29.88 1.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.025 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.57 -70.99 0.73 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.74 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.8 p -70.15 179.59 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.954 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.432 ' CE2' HG23 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -69.96 -155.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.967 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -99.24 -178.47 3.93 Favored 'General case' 0 N--CA 1.458 -0.071 0 CA-C-N 116.614 -0.267 . . . . 1.0 110.535 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.441 ' CG2' ' HA ' ' A' ' 7' ' ' TRP . 4.8 p -170.21 157.39 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.811 0.339 . . . . 1.0 111.82 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.5 p -99.54 117.63 34.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.789 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.5 p -109.32 117.27 53.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.68 -0.236 . . . . 1.0 111.61 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.424 ' HD3' ' HB3' ' A' ' 6' ' ' LYS . 29.1 Cg_endo -59.79 132.08 43.32 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.843 2.362 . . . . 1.0 113.14 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -70.71 -47.18 61.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.598 -0.728 . . . . 1.0 110.654 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.9 t . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.959 -0.564 . . . . 1.0 110.998 -179.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.66 0.267 . . . . 1.0 111.061 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -69.96 140.55 88.72 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.265 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -62.2 149.96 88.62 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.391 2.06 . . . . 1.0 112.03 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.463 ' HB3' ' CD1' ' A' ' 7' ' ' TRP . 17.4 mtmm -60.53 165.69 3.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 1.0 110.955 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.463 ' CD1' ' HB3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 46.91 69.98 0.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.067 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' HD3' ' N ' ' A' ' 9' ' ' GLY . 4.4 tmtm? -129.46 132.15 46.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.839 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.412 ' N ' ' HD3' ' A' ' 8' ' ' LYS . . . -48.94 139.74 12.58 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 121.235 -0.507 . . . . 1.0 112.811 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.8 p -106.04 -3.22 21.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.511 0.196 . . . . 1.0 111.396 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.25 64.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.827 0.346 . . . . 1.0 111.373 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.41 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 1.4 p30 -153.89 -86.87 0.06 Allowed 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.855 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 -88.15 -11.89 45.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.597 0.237 . . . . 1.0 111.32 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 53.81 79.22 0.13 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.0 0.429 . . . . 1.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.67 6.82 6.45 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.818 -0.705 . . . . 1.0 112.743 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -69.89 -13.98 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.991 0.395 . . . . 1.0 111.034 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.428 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 84.8 m -59.23 142.49 51.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.589 -0.278 . . . . 1.0 110.501 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.433 ' HB3' HD12 ' A' ' 21' ' ' LEU . 46.4 t -56.98 -103.36 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.428 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.402 ' N ' HD12 ' A' ' 21' ' ' LEU . 17.0 mm-40 -63.97 -157.19 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.079 -0.341 . . . . 1.0 110.079 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.82 42.4 2.04 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.521 -0.847 . . . . 1.0 112.935 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.433 HD12 ' HB3' ' A' ' 18' ' ' CYS . 0.2 OUTLIER -71.68 148.67 46.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.8 0.333 . . . . 1.0 110.894 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -123.84 148.85 46.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.186 0.517 . . . . 1.0 110.856 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 6.8 p -90.79 119.07 30.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.089 -0.505 . . . . 1.0 111.47 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' OE1' ' A' ' 22' ' ' GLU . 35.8 m0 -101.09 125.67 47.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.716 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -73.78 136.51 43.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 1.0 110.475 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.99 -168.45 1.46 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.331 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -46.92 87.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.622 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.71 -42.3 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.636 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.3 t -59.07 173.03 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.011 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -167.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.366 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.26 146.24 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.457 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.431 ' HB ' ' HA ' ' A' ' 7' ' ' TRP . 3.9 m -128.36 137.64 56.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.953 0.406 . . . . 1.0 111.377 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -61.77 146.49 49.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.145 -0.479 . . . . 1.0 111.521 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.8 p -147.12 127.17 6.73 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.896 -0.593 . . . . 1.0 110.831 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -56.91 131.12 43.58 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.877 2.385 . . . . 1.0 112.929 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 ptmm? -70.14 -100.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.728 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.5 m . . . . . 0 C--N 1.333 -0.144 0 CA-C-O 120.485 0.183 . . . . 1.0 110.667 179.646 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.655 0.264 . . . . 1.0 111.04 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.412 HG12 ' HA ' ' A' ' 17' ' ' CYS . 1.4 pp -70.13 157.82 88.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.264 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -75.12 120.01 5.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.781 2.321 . . . . 1.0 111.928 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' C ' ' CG ' ' A' ' 7' ' ' TRP . 12.1 mttt -51.11 148.02 4.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 1.0 111.363 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.44 ' CG ' ' C ' ' A' ' 6' ' ' LYS . 0.7 OUTLIER 44.04 68.94 0.46 Allowed 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 115.859 -0.61 . . . . 1.0 111.98 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.2 mmtt -148.28 173.81 12.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 1.0 110.831 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -48.31 152.46 2.34 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 121.034 -0.603 . . . . 1.0 112.771 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 31' ' ' GLU . 62.6 m -96.54 0.51 50.21 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.59 0.219 . . . . 1.0 111.59 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -49.79 89.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 120.936 0.398 . . . . 1.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.6 t-20 173.61 84.49 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 1.0 109.997 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.11 27.71 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 42.71 32.79 0.41 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.948 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.09 37.58 0.04 OUTLIER Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.131 -1.033 . . . . 1.0 113.195 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -107.41 14.75 25.62 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.679 0.276 . . . . 1.0 110.611 179.47 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.496 ' HB3' HD12 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -57.1 177.23 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.655 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.421 ' HB3' HD11 ' A' ' 21' ' ' LEU . 50.3 t -70.17 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.029 -0.268 . . . . 1.0 111.524 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' N ' HD13 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.66 -152.25 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.614 0.245 . . . . 1.0 110.745 179.831 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.96 37.38 2.52 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.707 -0.759 . . . . 1.0 112.788 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.519 HD13 ' N ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -69.86 145.03 52.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.009 0.433 . . . . 1.0 110.726 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -91.7 159.44 15.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.702 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.58 114.46 27.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.864 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.5 m0 -99.28 101.17 12.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.87 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 140.27 36.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 1.0 110.762 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -105.27 117.33 33.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.484 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -45.93 -31.5 2.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.108 -0.496 . . . . 1.0 111.221 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mmt-85 -85.88 -86.62 0.14 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.631 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.0 t -70.39 -164.16 0.08 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.833 0.349 . . . . 1.0 110.856 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -154.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.484 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 10' ' ' CYS . 23.5 mt-10 -109.59 175.64 5.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.666 -0.243 . . . . 1.0 110.368 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.2 t -152.79 139.38 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 1.0 111.706 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 151.46 21.48 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.958 -0.565 . . . . 1.0 110.409 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -145.25 122.52 6.25 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 111.642 0.238 . . . . 1.0 111.642 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -61.96 142.09 91.7 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.24 2.627 . . . . 1.0 112.54 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.221 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.602 -0.272 . . . . 1.0 111.254 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.522 -0.102 0 CA-C-O 121.01 0.433 . . . . 1.0 111.159 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.426 ' HB ' ' CD ' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -69.71 172.07 6.11 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.426 ' CD ' ' HB ' ' A' ' 4' ' ' ILE . 13.3 Cg_exo -68.77 116.16 4.3 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.672 2.248 . . . . 1.0 111.851 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -88.99 39.81 0.95 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.268 -179.68 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.428 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 43.1 m95 -150.22 22.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.0 110.666 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 mmtm -115.6 158.5 22.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.028 0.442 . . . . 1.0 111.07 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.0 173.67 0.59 Allowed Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.792 -0.64 . . . . 1.0 113.092 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 t -106.55 -2.76 21.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.585 0.231 . . . . 1.0 111.514 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.7 p -76.88 60.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.944 0.402 . . . . 1.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -178.64 -56.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 1.0 110.728 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -48.19 18.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.17 32.05 10.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.938 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 111.56 4.78 26.52 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.902 -0.666 . . . . 1.0 112.539 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -0.83 50.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.828 0.314 . . . . 1.0 111.312 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.0 m -53.35 170.57 0.09 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.682 -0.235 . . . . 1.0 110.761 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.491 ' C ' HD13 ' A' ' 21' ' ' LEU . 21.8 p -63.43 -123.94 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 121.231 -0.188 . . . . 1.0 111.451 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 21' ' ' LEU . 1.1 mt-10 -46.77 91.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 112.866 0.691 . . . . 1.0 112.866 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' GLU . . . 18.15 45.61 0.01 OUTLIER Glycine 0 C--N 1.337 0.608 0 CA-C-N 114.962 -1.017 . . . . 1.0 115.452 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 19' ' ' GLU . 3.0 mp -68.83 161.05 29.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 117.207 0.503 . . . . 1.0 110.894 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -132.89 133.74 43.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.428 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 8.1 p -84.51 115.56 22.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.08 0.467 . . . . 1.0 111.127 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.402 ' CD2' HG22 ' A' ' 34' ' ' VAL . 52.0 m0 -90.19 134.21 34.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.591 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 142.86 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.955 0.407 . . . . 1.0 110.956 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -115.66 135.43 54.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 1.0 110.464 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.98 -50.43 19.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.672 -0.694 . . . . 1.0 111.433 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -89.04 -71.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.19 173.99 6.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.751 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -146.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.516 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -107.63 131.47 54.35 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 110.447 -0.205 . . . . 1.0 110.447 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 23.4 m -115.41 138.57 45.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.632 0.254 . . . . 1.0 111.625 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -66.01 147.12 53.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.545 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.402 HG22 ' CD2' ' A' ' 24' ' ' TRP . 2.4 m -149.92 125.13 4.84 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -56.61 132.79 53.9 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.768 2.312 . . . . 1.0 112.943 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -70.26 -111.31 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.761 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 CA--C 1.531 0.232 0 O-C-N 122.297 -0.252 . . . . 1.0 111.028 179.965 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 120.541 0.21 . . . . 1.0 111.198 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.416 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.4 pp -63.73 140.38 97.8 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.635 -0.257 . . . . 1.0 111.186 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.0 148.15 93.65 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.528 2.152 . . . . 1.0 112.303 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -95.19 38.51 1.13 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.885 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -156.86 27.99 0.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.701 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.14 166.54 13.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.49 35.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.725 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.96 26.73 8.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.709 0.29 . . . . 1.0 110.979 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.425 HG21 ' CE2' ' A' ' 30' ' ' PHE . 22.0 t -100.6 71.88 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.142 0.496 . . . . 1.0 111.091 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -176.83 -62.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 1.0 110.613 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.68 -46.3 22.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 55.7 87.2 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.05 -12.8 9.77 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.386 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -11.67 61.07 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.642 0.258 . . . . 1.0 111.185 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.437 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.3 m -48.44 144.83 3.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.708 -0.224 . . . . 1.0 110.55 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.3 t -59.61 -102.6 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.218 -0.193 . . . . 1.0 111.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.3 -157.59 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 N-CA-C 110.291 -0.263 . . . . 1.0 110.291 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.17 43.12 2.44 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.508 -0.854 . . . . 1.0 112.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.437 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.71 148.72 48.87 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 120.972 0.415 . . . . 1.0 111.216 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -111.76 151.05 29.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 1.0 111.29 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.2 m -78.17 120.21 22.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.673 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.419 ' CD2' HG13 ' A' ' 34' ' ' VAL . 6.9 m0 -119.02 139.37 51.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.863 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -81.67 147.39 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.963 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -120.02 138.81 53.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.104 0.478 . . . . 1.0 110.543 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.12 -57.93 7.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 1.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -71.91 0.42 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.724 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.99 170.3 8.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.845 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.425 ' CE2' HG21 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.24 -145.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.112 -0.495 . . . . 1.0 110.935 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -97.21 126.63 42.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.781 0.324 . . . . 1.0 110.769 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.6 m -124.15 152.21 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 116.343 -0.389 . . . . 1.0 111.563 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.19 149.05 37.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.215 -0.448 . . . . 1.0 111.173 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.419 HG13 ' CD2' ' A' ' 24' ' ' TRP . 10.8 p -148.58 137.34 11.86 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.527 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -56.58 138.27 84.04 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.954 2.436 . . . . 1.0 112.484 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -102.76 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.135 -0.484 . . . . 1.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.494 0.188 . . . . 1.0 111.126 -179.898 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 18' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.674 0.273 . . . . 1.0 110.745 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.1 pt -60.0 157.48 30.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.503 -0.317 . . . . 1.0 110.648 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.425 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 52.5 Cg_exo -53.46 96.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 122.385 2.057 . . . . 1.0 112.002 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.76 151.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.29 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.41 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 38.6 m0 63.4 49.88 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.231 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 5' ' ' PRO . 1.5 tptp -117.04 152.76 33.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 1.0 110.809 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.43 158.23 23.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.681 -0.771 . . . . 1.0 112.22 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -3.49 45.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.528 0.204 . . . . 1.0 111.325 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -69.02 69.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.908 0.385 . . . . 1.0 110.843 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.6 t-20 -177.97 80.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.054 -0.521 . . . . 1.0 110.506 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.8 OUTLIER 68.22 12.12 8.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.572 . . . . 1.0 111.351 -179.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 42.34 79.43 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.859 0.361 . . . . 1.0 111.511 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.81 46.01 0.62 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -96.45 23.79 6.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.906 0.384 . . . . 1.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.426 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.2 m -70.11 144.56 52.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.403 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.525 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 1.6 p -55.71 -105.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.568 -0.287 . . . . 1.0 111.748 -179.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.607 ' N ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -57.28 -155.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.644 0.259 . . . . 1.0 110.812 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.49 32.02 0.58 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.766 -0.731 . . . . 1.0 114.429 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.607 HD12 ' N ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.13 140.06 46.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.744 0.772 . . . . 1.0 110.186 179.143 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -108.66 162.89 13.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.906 0.384 . . . . 1.0 111.158 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.85 100.38 13.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.729 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 25.7 m0 -100.35 144.64 29.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.073 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.56 133.26 39.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.721 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.97 -172.25 2.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.012 0.434 . . . . 1.0 110.759 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -70.27 -71.52 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.811 -0.632 . . . . 1.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -70.88 -76.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.038 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -58.85 147.49 33.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 1.0 110.835 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.0 110.497 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.64 137.72 51.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.775 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.419 HG22 ' N ' ' A' ' 33' ' ' CYS . 11.2 p -132.8 145.27 34.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.373 -0.376 . . . . 1.0 111.268 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.419 ' N ' HG22 ' A' ' 32' ' ' VAL . 53.4 m -61.8 137.27 58.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.961 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.52 126.93 7.62 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.801 -0.182 . . . . 1.0 111.348 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -59.53 141.85 97.96 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.92 2.413 . . . . 1.0 112.486 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -49.79 -62.68 1.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.041 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.5 m . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.686 179.857 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HB2' ' HA ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.233 0 CA-C-O 120.656 0.265 . . . . 1.0 110.748 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.6 pp -51.9 141.29 28.27 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 1.0 111.66 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -80.08 158.79 23.74 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.787 2.325 . . . . 1.0 111.862 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -62.04 161.5 10.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.952 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 42.6 m0 62.78 48.06 4.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.921 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -130.03 142.32 50.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.31 175.81 2.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 1.0 112.641 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.9 t -104.95 1.88 29.21 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.576 0.214 . . . . 1.0 111.576 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.0 p -67.39 68.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 CA-C-O 121.124 0.488 . . . . 1.0 111.11 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -169.95 76.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.591 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 75.61 7.17 3.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.245 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 49.04 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.317 . . . . 1.0 111.35 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.4 38.8 1.07 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.962 -0.637 . . . . 1.0 112.495 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.91 20.42 13.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.649 0.262 . . . . 1.0 111.252 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -55.39 147.3 17.54 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.561 0.219 . . . . 1.0 110.562 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 42.4 t -61.84 -96.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.617 -0.265 . . . . 1.0 110.939 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -154.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.028 -0.36 . . . . 1.0 110.028 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.47 33.43 1.59 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.594 -0.812 . . . . 1.0 112.896 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -78.62 157.08 28.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.909 0.385 . . . . 1.0 111.042 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -132.2 126.24 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.347 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 13.2 p -69.48 109.69 4.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.084 0.469 . . . . 1.0 111.115 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.418 ' CE3' HG22 ' A' ' 34' ' ' VAL . 51.2 m0 -97.4 143.74 27.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.861 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -67.5 146.89 53.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 1.0 110.895 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -128.01 -177.75 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.575 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -78.51 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.898 -0.592 . . . . 1.0 111.229 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.39 -73.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.331 -0.395 . . . . 1.0 111.12 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -65.59 168.21 7.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.45 -0.341 . . . . 1.0 110.95 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -81.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.42 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -153.39 136.38 15.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.31 -0.404 . . . . 1.0 110.64 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.2 m -121.13 141.63 40.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.36 -0.382 . . . . 1.0 111.487 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 79.6 m -58.79 133.35 55.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.02 -0.537 . . . . 1.0 111.323 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.418 HG22 ' CE3' ' A' ' 24' ' ' TRP . 5.2 m -137.66 133.32 17.83 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.028 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.2 136.94 75.55 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.971 2.448 . . . . 1.0 112.403 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -51.21 -47.05 62.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.8 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.87 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.737 0.303 . . . . 1.0 111.18 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.437 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.3 pp -70.3 143.34 90.69 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.4 -0.364 . . . . 1.0 111.258 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 3.0 Cg_exo -73.65 140.36 29.4 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.553 2.169 . . . . 1.0 111.661 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.487 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 1.0 OUTLIER -55.52 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.984 0.421 . . . . 1.0 111.103 -179.848 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.487 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 48.0 p-90 41.14 32.34 0.18 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.748 -0.66 . . . . 1.0 111.344 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.83 143.93 31.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 1.0 111.066 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.58 152.49 51.53 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.574 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.9 m -86.13 -4.74 59.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.641 0.258 . . . . 1.0 111.417 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.51 72.5 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.957 0.408 . . . . 1.0 110.953 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -176.23 78.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.974 -0.557 . . . . 1.0 110.826 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 74.63 4.33 4.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.642 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 47.13 83.93 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.761 0.315 . . . . 1.0 111.247 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.49 38.21 0.6 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.662 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.97 10.11 42.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.507 0.194 . . . . 1.0 111.295 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.461 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 10.0 m -65.9 152.24 44.93 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.656 -0.247 . . . . 1.0 110.534 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.22 -100.64 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.769 -0.196 . . . . 1.0 111.048 -179.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -70.13 -161.65 0.05 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.467 0.175 . . . . 1.0 110.558 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.45 47.88 2.12 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.609 -0.805 . . . . 1.0 112.192 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.461 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -70.08 151.1 45.88 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.968 0.413 . . . . 1.0 111.069 -179.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.94 142.9 26.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.988 -0.551 . . . . 1.0 111.222 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 23.0 t -89.24 103.32 15.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.986 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -81.22 90.09 6.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.75 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.96 133.97 33.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.264 0.554 . . . . 1.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -99.12 117.9 34.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.947 -0.57 . . . . 1.0 110.649 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 -43.27 -31.91 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.369 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -59.14 1.99 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.353 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.06 -179.81 2.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.012 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.08 -166.74 0.13 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.009 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -113.14 160.25 18.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.589 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -160.05 131.42 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.582 -0.281 . . . . 1.0 111.207 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.48 149.33 28.79 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.397 -0.365 . . . . 1.0 111.127 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 p -145.35 136.48 12.52 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 1.0 111.287 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.87 138.63 86.78 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.201 2.601 . . . . 1.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.458 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -69.72 -40.01 76.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.159 -0.473 . . . . 1.0 111.076 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.458 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.4 m . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.145 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 4.1 m . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.404 0.145 . . . . 1.0 111.018 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.2 pp -70.52 158.13 88.47 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.273 . . . . 1.0 111.263 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -59.63 98.37 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.434 2.09 . . . . 1.0 111.646 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -46.33 134.49 8.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.003 0.43 . . . . 1.0 111.576 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 28.3 m0 64.29 75.68 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.173 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -156.5 174.55 15.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.61 179.55 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -55.31 132.13 49.04 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.847 -0.692 . . . . 1.0 112.791 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -98.61 23.64 8.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.623 0.249 . . . . 1.0 111.217 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' CD2' ' A' ' 30' ' ' PHE . 20.1 t -75.62 77.75 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.939 0.4 . . . . 1.0 110.972 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -176.9 78.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 73.6 5.32 4.9 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.211 -0.449 . . . . 1.0 111.691 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.98 34.52 2.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.629 0.252 . . . . 1.0 111.383 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 179.46 35.79 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.411 -0.9 . . . . 1.0 112.816 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.28 14.68 31.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 1.0 110.938 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -70.08 167.62 17.28 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.464 -0.335 . . . . 1.0 111.036 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 42.0 t -67.47 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.236 -0.438 . . . . 1.0 111.45 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -155.12 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.56 0.219 . . . . 1.0 110.639 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.25 34.6 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.618 -0.801 . . . . 1.0 113.282 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.67 150.24 47.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.9 0.35 . . . . 1.0 110.671 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -126.3 144.27 50.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.066 0.46 . . . . 1.0 111.112 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.4 m -73.88 124.47 26.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.839 -0.619 . . . . 1.0 110.782 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.427 ' CG ' HG11 ' A' ' 34' ' ' VAL . 22.3 m0 -113.73 122.98 48.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.899 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -57.47 150.94 17.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.001 0.429 . . . . 1.0 110.92 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.07 141.53 48.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.547 . . . . 1.0 110.592 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -41.5 66.64 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 1.0 111.134 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.49 -81.97 0.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.785 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.83 -179.84 1.97 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.758 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -69.96 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.52 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 mp0 -140.82 140.25 34.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 1.0 110.753 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -122.98 129.12 75.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 1.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 149.49 40.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.221 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG11 ' CG ' ' A' ' 24' ' ' TRP . 11.5 p -147.45 123.59 5.46 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.441 -0.345 . . . . 1.0 111.364 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.23 138.59 85.74 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.61 2.207 . . . . 1.0 112.651 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -30.2 70.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.892 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.2 m . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.97 -179.828 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.724 0.297 . . . . 1.0 110.861 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -70.18 158.6 87.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.848 0.356 . . . . 1.0 110.946 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -61.12 93.76 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.476 2.117 . . . . 1.0 112.23 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -61.72 146.68 48.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.787 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 35.3 m95 61.69 38.48 15.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.075 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.8 mmtm -131.07 -176.14 3.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.879 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.49 -170.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.655 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.41 ' O ' ' ND1' ' A' ' 14' ' ' HIS . 1.6 m -115.06 -4.74 12.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 111.606 0.224 . . . . 1.0 111.606 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 18.9 t -68.2 63.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.848 0.356 . . . . 1.0 111.389 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 56.9 t-20 174.34 83.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.329 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 mmm180 70.38 76.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.307 0.575 . . . . 1.0 110.427 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.41 ' ND1' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -72.14 51.11 0.23 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.302 -0.863 . . . . 1.0 111.338 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.6 -27.07 0.22 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.536 -0.84 . . . . 1.0 112.62 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.89 26.81 3.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.759 0.314 . . . . 1.0 110.997 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -49.91 176.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.406 ' N ' HD13 ' A' ' 21' ' ' LEU . 41.5 t -55.37 -101.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.671 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.499 ' O ' ' CG ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -70.78 75.5 0.61 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.924 0.392 . . . . 1.0 110.707 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 33.05 33.95 0.02 OUTLIER Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.92 -0.582 . . . . 1.0 113.546 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -69.33 150.73 47.03 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 120.911 0.386 . . . . 1.0 111.181 -179.498 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -101.85 164.22 11.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.655 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.17 115.53 30.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.704 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.43 ' CD2' HG13 ' A' ' 34' ' ' VAL . 23.4 m0 -99.99 100.82 11.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.7 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.71 141.55 28.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.845 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 125.17 50.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.435 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -44.44 -30.18 0.82 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.414 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.3 -67.43 0.92 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.761 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p -69.24 179.31 2.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 1.0 111.118 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -162.23 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 1.0 111.249 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.43 139.12 53.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.54 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.4 m -133.03 163.69 37.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.279 -0.419 . . . . 1.0 111.167 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.45 150.5 21.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.933 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.43 HG13 ' CD2' ' A' ' 24' ' ' TRP . 11.6 p -150.84 137.28 11.22 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.998 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -58.67 140.28 94.27 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.993 2.462 . . . . 1.0 112.564 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -43.14 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.995 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.02 -179.854 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.779 0.323 . . . . 1.0 111.199 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -60.28 155.88 16.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.85 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -66.04 178.3 1.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 1.0 110.989 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.428 ' CD1' ' N ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER -70.08 121.11 81.93 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.102 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.96 141.22 93.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.22 1.947 . . . . 1.0 111.706 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 pttm -71.69 154.19 41.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.908 0.385 . . . . 1.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 20.5 m95 56.04 28.77 13.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.027 -0.533 . . . . 1.0 111.311 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 2.0 tptt -109.85 152.59 25.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.417 . . . . 1.0 110.754 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.69 162.83 0.05 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.219 -0.515 . . . . 1.0 113.214 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.15 -8.58 35.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.547 0.213 . . . . 1.0 111.498 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 22.0 t -41.19 159.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.473 -0.33 . . . . 1.0 111.413 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.47 ' HB3' ' O ' ' A' ' 11' ' ' VAL . 56.8 t-20 75.2 83.36 0.1 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.979 0.418 . . . . 1.0 110.285 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 21.9 mmt-85 83.21 -16.71 0.55 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.482 -0.781 . . . . 1.0 112.07 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.61 87.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.796 0.332 . . . . 1.0 111.276 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.03 34.46 2.76 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.664 -0.779 . . . . 1.0 112.536 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.95 24.89 7.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.652 0.263 . . . . 1.0 111.048 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.407 ' HB3' HD13 ' A' ' 21' ' ' LEU . 35.2 m -42.91 150.45 0.16 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.056 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.2 t -70.13 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.91 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.89 -154.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.231 -0.285 . . . . 1.0 110.231 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.55 28.46 2.08 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.753 -0.736 . . . . 1.0 112.941 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -69.77 144.19 52.76 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.715 0.293 . . . . 1.0 110.624 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -106.65 137.15 45.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 1.0 111.002 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.95 112.4 20.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.992 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -95.1 122.13 37.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.915 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' CA ' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -84.8 133.86 34.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.871 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.64 -159.69 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.591 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -51.47 52.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.348 -0.387 . . . . 1.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.52 -43.11 1.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.905 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 p -57.53 177.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.15 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' CD1' ' N ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -66.04 -167.14 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.463 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.41 ' HB3' ' CA ' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -111.04 161.32 16.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.403 179.615 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 2.0 m -131.74 127.66 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 1.0 111.179 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.6 m -61.73 127.4 31.24 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.768 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.6 m -124.68 115.04 26.83 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.759 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.16 134.52 59.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.622 2.215 . . . . 1.0 112.69 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.993 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.421 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -70.17 139.87 87.73 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.556 -0.293 . . . . 1.0 110.598 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 57.5 Cg_endo -92.67 -88.93 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 122.944 2.43 . . . . 1.0 112.529 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.27 -78.6 0.07 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.783 0.325 . . . . 1.0 111.115 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 66.6 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.227 -0.892 . . . . 1.0 110.946 -179.952 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.822 0.344 . . . . 1.0 111.397 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -60.15 119.09 7.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.847 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.02 177.71 0.23 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.282 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.428 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -70.34 147.66 95.25 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.721 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 1.7 Cg_endo -79.83 119.6 4.04 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.563 2.175 . . . . 1.0 111.461 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.89 145.23 46.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.896 0.379 . . . . 1.0 111.009 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.43 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 9.4 m95 59.7 49.21 8.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.997 -0.547 . . . . 1.0 111.501 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -141.89 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.868 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.48 145.36 1.34 Allowed Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.005 -0.543 . . . . 1.0 113.191 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -95.66 0.76 53.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.386 0.143 . . . . 1.0 111.386 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.7 t -53.58 86.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 120.977 0.418 . . . . 1.0 111.559 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.1 t-20 175.41 81.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.415 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 mmt-85 68.57 10.58 7.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.19 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 45.98 71.19 0.31 Allowed 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.899 0.381 . . . . 1.0 111.445 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 123.95 40.75 0.44 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.62 -0.8 . . . . 1.0 113.012 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 5.1 m-20 -100.46 23.02 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.427 0.156 . . . . 1.0 110.931 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.435 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 29.8 m -47.25 151.83 0.66 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.642 -0.254 . . . . 1.0 110.889 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 t -67.81 -97.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.15 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.42 ' HG3' ' CG ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.87 -155.03 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.214 -0.291 . . . . 1.0 110.214 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.88 31.37 0.75 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.651 -0.785 . . . . 1.0 114.346 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.435 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -78.16 147.14 34.67 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 117.591 0.696 . . . . 1.0 110.603 179.358 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -102.85 150.82 23.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.0 t -91.19 112.41 24.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.0 m0 -105.68 163.66 12.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.988 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -116.68 151.71 35.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.911 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.41 126.09 53.08 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.591 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -38.67 4.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.946 -0.57 . . . . 1.0 111.074 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.78 -68.11 0.83 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.902 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.58 176.19 3.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -70.25 -152.67 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.913 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -95.56 160.35 14.55 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 120.664 0.268 . . . . 1.0 110.687 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 99.8 t -155.93 140.33 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.461 -0.336 . . . . 1.0 111.278 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 20.3 m -75.05 139.01 42.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.257 -0.429 . . . . 1.0 110.513 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.0 m -128.29 120.92 21.28 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-O 120.491 0.186 . . . . 1.0 111.284 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -61.34 141.86 94.02 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.04 2.494 . . . . 1.0 112.325 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -48.73 -76.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.6 t -69.77 110.56 6.75 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.889 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.23 71.42 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.736 2.291 . . . . 1.0 112.249 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.31 -63.69 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 1.0 111.198 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.225 -0.893 . . . . 1.0 111.049 179.871 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.836 0.351 . . . . 1.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -60.34 86.27 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -65.85 168.28 8.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.224 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.411 ' CG2' ' HA ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -70.11 125.13 91.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.529 -0.305 . . . . 1.0 111.255 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.13 124.39 14.29 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.492 2.128 . . . . 1.0 112.119 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.477 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.88 -170.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.03 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.477 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 31.5 p-90 43.09 47.6 5.19 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.301 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.404 ' CD ' ' C ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -134.13 158.55 43.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.584 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.402 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -77.15 143.61 28.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.686 -0.769 . . . . 1.0 112.255 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.2 p -116.14 34.39 5.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.799 0.333 . . . . 1.0 111.31 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.428 HG23 ' CD2' ' A' ' 30' ' ' PHE . 19.0 t -54.56 128.23 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.329 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 59.5 18.92 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.279 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -149.66 66.2 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.256 0.55 . . . . 1.0 110.801 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.73 50.32 0.83 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.674 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 171.66 33.01 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.783 -0.723 . . . . 1.0 113.045 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.42 4.45 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.517 0.199 . . . . 1.0 110.628 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.411 ' HA ' ' CG2' ' A' ' 4' ' ' ILE . 86.6 m -70.34 148.52 48.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.788 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -69.96 -93.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.366 -0.379 . . . . 1.0 110.897 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.41 -159.6 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.6 0.238 . . . . 1.0 110.747 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.29 41.38 2.46 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.587 -0.816 . . . . 1.0 112.751 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mp -69.84 164.84 22.81 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 120.972 0.415 . . . . 1.0 111.389 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -135.24 134.01 39.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.661 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.18 107.36 9.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.942 0.401 . . . . 1.0 110.82 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -93.45 126.12 38.42 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.292 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -74.17 136.98 42.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.467 . . . . 1.0 110.812 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -91.21 -162.97 0.97 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.584 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -70.03 -66.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 1.0 110.904 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.21 -52.37 2.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.79 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.88 171.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.962 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.428 ' CD2' HG23 ' A' ' 11' ' ' VAL . 1.3 t80 -68.6 -157.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.761 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 5.4 pt-20 -102.3 138.41 39.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 1.0 110.909 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.1 m -109.6 135.17 49.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.113 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 14.2 t -59.72 135.85 57.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.093 -0.503 . . . . 1.0 111.414 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.4 p -143.05 132.91 11.97 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-O 120.715 0.293 . . . . 1.0 111.363 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -59.97 140.14 91.34 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.922 2.414 . . . . 1.0 112.576 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -66.37 -47.04 74.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.988 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -70.08 151.88 95.94 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.89 -0.595 . . . . 1.0 110.939 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 3.6 Cg_exo -76.82 86.24 1.63 Allowed 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.853 2.369 . . . . 1.0 112.126 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.8 138.59 58.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.933 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.5 m . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.197 -0.906 . . . . 1.0 110.815 -179.913 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.592 0.234 . . . . 1.0 111.26 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.26 122.79 14.06 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.047 0.451 . . . . 1.0 110.96 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.15 163.76 5.89 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.044 -0.526 . . . . 1.0 111.061 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -70.05 147.37 95.69 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 1.0 111.216 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -64.11 130.7 28.05 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.622 2.215 . . . . 1.0 111.955 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.17 149.86 27.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 1.0 110.661 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER 63.11 36.42 12.22 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.836 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -101.19 149.95 23.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.477 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.499 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -45.58 173.83 0.01 OUTLIER Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.3 -0.476 . . . . 1.0 113.531 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.427 ' O ' ' N ' ' A' ' 12' ' ' ASN . 19.3 t -104.45 -12.63 16.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.585 0.231 . . . . 1.0 111.424 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.97 82.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.993 0.425 . . . . 1.0 111.206 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 10' ' ' CYS . 6.0 t-20 177.46 75.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.473 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 65.51 14.99 9.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.421 -179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 48.28 84.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.786 0.327 . . . . 1.0 111.334 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 109.37 53.31 0.6 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.58 -0.819 . . . . 1.0 112.517 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -111.43 20.73 16.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.562 0.22 . . . . 1.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.404 ' HA ' HG12 ' A' ' 4' ' ' ILE . 4.2 m -61.9 163.71 7.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.514 -0.312 . . . . 1.0 110.444 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.6 t -55.35 -94.71 0.0 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.77 -0.195 . . . . 1.0 110.798 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -66.64 -154.94 0.01 OUTLIER 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.1 -0.333 . . . . 1.0 110.1 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.49 33.27 1.59 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 1.0 113.001 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.71 151.47 45.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.93 0.365 . . . . 1.0 111.138 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -118.67 134.48 55.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.165 0.507 . . . . 1.0 110.291 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 14.6 p -79.1 126.9 31.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 33.0 m0 -108.78 135.99 49.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.011 -0.54 . . . . 1.0 111.203 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.5 tptm -90.1 134.65 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.458 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 174.93 5.67 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.084 0.468 . . . . 1.0 110.673 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -73.05 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.804 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -71.01 -66.98 0.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.548 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 p -69.28 152.14 45.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.213 -0.448 . . . . 1.0 110.714 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -147.11 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.731 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 8.5 mt-10 -89.92 169.44 11.23 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.841 0.353 . . . . 1.0 110.756 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.71 139.9 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 33.8 m -69.97 140.37 52.97 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.176 -0.466 . . . . 1.0 111.059 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.2 p -143.2 138.24 15.48 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.674 -0.239 . . . . 1.0 111.095 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -58.16 139.92 92.28 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.927 2.418 . . . . 1.0 112.747 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.532 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -51.18 -39.05 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 1.0 110.974 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.532 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 8.8 t -65.11 145.5 99.08 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.901 -0.591 . . . . 1.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 3.0 Cg_exo -75.38 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.668 2.245 . . . . 1.0 112.087 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -67.05 130.84 44.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.988 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.4 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.108 -0.948 . . . . 1.0 110.788 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.943 0.401 . . . . 1.0 111.244 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.25 116.18 4.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 2.4 m -70.16 -95.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.702 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.46 HG21 ' HA ' ' A' ' 17' ' ' CYS . 11.0 tt -70.63 140.98 87.22 Favored Pre-proline 0 N--CA 1.455 -0.183 0 O-C-N 122.393 -0.192 . . . . 1.0 110.798 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.404 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 44.3 Cg_exo -54.19 113.18 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.085 1.857 . . . . 1.0 111.828 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.23 145.67 46.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.875 0.369 . . . . 1.0 110.806 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.8 m0 67.68 19.35 9.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.805 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 5' ' ' PRO . 0.4 OUTLIER -110.23 173.8 6.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.729 0.299 . . . . 1.0 110.806 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.3 150.94 28.68 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.836 -0.697 . . . . 1.0 112.63 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 12' ' ' ASN . 21.0 p -115.1 19.06 15.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.475 0.179 . . . . 1.0 111.311 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.47 82.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.85 0.357 . . . . 1.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 10' ' ' CYS . 4.6 t-20 177.59 81.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.568 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.408 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 73.84 5.47 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.742 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.23 83.63 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 120.888 0.375 . . . . 1.0 111.33 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.08 34.41 0.89 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.596 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.64 22.03 13.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.664 0.269 . . . . 1.0 110.858 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.46 ' HA ' HG21 ' A' ' 4' ' ' ILE . 11.6 m -58.41 165.59 2.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 1.0 110.674 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 39.5 t -70.24 -88.57 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.387 -0.369 . . . . 1.0 111.915 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -67.88 66.47 0.1 Allowed 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.879 0.371 . . . . 1.0 111.702 -178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 39.97 26.64 0.1 Allowed Glycine 0 C--O 1.225 -0.433 0 C-N-CA 121.228 -0.511 . . . . 1.0 113.817 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.27 151.16 46.6 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 120.983 0.42 . . . . 1.0 110.576 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -101.54 159.03 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 1.0 110.774 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.8 t -98.51 120.25 38.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.921 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.7 m0 -109.69 130.98 55.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.78 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.69 148.29 25.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.7 mmt-85 -114.03 129.51 56.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.643 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.13 -30.39 1.12 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.448 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 -82.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.63 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.6 p -70.14 -177.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.915 0.388 . . . . 1.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -153.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.662 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -113.32 136.83 52.33 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.806 0.336 . . . . 1.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.7 m -126.04 163.99 26.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.302 -0.408 . . . . 1.0 111.374 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.3 m -69.23 161.07 29.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.738 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.9 p -170.33 138.16 1.36 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.382 -0.372 . . . . 1.0 110.938 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -53.85 136.04 64.8 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.004 2.469 . . . . 1.0 112.554 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -89.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.326 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -70.21 142.46 89.93 Favored Pre-proline 0 CA--C 1.53 0.188 0 O-C-N 122.397 -0.19 . . . . 1.0 110.926 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 9.2 Cg_endo -88.36 150.11 6.55 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.102 2.535 . . . . 1.0 112.079 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.61 82.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.302 -0.408 . . . . 1.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.31 -0.852 . . . . 1.0 110.848 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.92 0.391 . . . . 1.0 111.289 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -58.6 124.76 20.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.934 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.4 m -66.0 147.75 52.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.328 -0.396 . . . . 1.0 110.776 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 pp -70.1 141.76 89.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.229 . . . . 1.0 111.207 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -68.45 140.24 47.43 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.534 2.156 . . . . 1.0 111.95 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -71.72 162.95 28.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 24.3 m0 60.14 31.48 20.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.024 -0.535 . . . . 1.0 111.271 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -120.06 147.72 44.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.517 179.867 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -71.07 136.68 25.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.059 -0.591 . . . . 1.0 112.845 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -94.32 27.45 2.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.689 0.281 . . . . 1.0 111.009 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.1 p -67.6 70.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 1.0 110.987 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -177.22 -70.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.442 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 7.5 mmm180 -95.84 -9.49 31.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.342 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 53.63 92.41 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-O 121.087 0.47 . . . . 1.0 110.832 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.72 48.81 4.81 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.238 -179.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.464 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 0.0 OUTLIER -88.08 5.27 41.9 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.515 -0.342 . . . . 1.0 111.204 -179.113 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 21' ' ' LEU . 57.3 m -45.69 138.8 4.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.946 0.403 . . . . 1.0 111.779 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 t -70.4 -83.31 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.377 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -63.79 -153.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.608 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 17.98 3.34 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.625 -0.797 . . . . 1.0 113.173 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.464 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -69.69 144.3 52.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.098 0.449 . . . . 1.0 110.525 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -116.07 160.01 20.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 1.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -91.61 109.71 21.02 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.85 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 36.9 m0 -115.64 149.54 38.16 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.29 -0.413 . . . . 1.0 111.291 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -70.7 128.4 35.94 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.006 -0.543 . . . . 1.0 110.93 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.416 ' HD2' ' CG2' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.88 -162.61 0.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.563 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -68.12 0.44 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.794 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 ttp-105 -103.89 -43.08 5.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.9 p -67.73 157.37 34.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.996 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -158.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.433 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 44.0 mt-10 -80.26 124.56 28.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 120.978 0.418 . . . . 1.0 110.887 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.416 ' CG2' ' HD2' ' A' ' 26' ' ' ARG . 34.7 m -117.3 160.99 16.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 1.0 111.048 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 5.0 m -69.51 142.41 53.69 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.284 -0.416 . . . . 1.0 111.131 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.0 p -142.34 120.16 7.37 Favored Pre-proline 0 C--N 1.323 -0.557 0 C-N-CA 122.195 0.198 . . . . 1.0 111.073 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.94 139.08 89.13 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.858 2.372 . . . . 1.0 112.475 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.94 -35.83 2.18 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.116 -0.493 . . . . 1.0 111.137 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 75.8 m -69.87 121.4 82.62 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.639 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 2.5 Cg_endo -80.12 -75.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.808 2.339 . . . . 1.0 112.24 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -70.23 83.27 0.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.992 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.158 -0.925 . . . . 1.0 110.97 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.035 0.445 . . . . 1.0 111.147 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -60.62 137.04 58.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.222 -0.444 . . . . 1.0 111.004 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.35 -176.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.03 142.33 90.29 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.188 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.17 124.88 15.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.512 2.141 . . . . 1.0 111.983 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -70.16 150.38 46.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 7' ' ' TRP . 2.0 m0 67.33 27.27 8.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 1.0 111.184 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.04 169.05 9.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.426 -0.352 . . . . 1.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 152.15 46.48 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.662 -0.78 . . . . 1.0 112.569 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.91 5.48 49.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.407 0.151 . . . . 1.0 111.407 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.5 p -70.93 65.41 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.085 0.469 . . . . 1.0 110.861 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -177.32 -54.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.871 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.41 ' HB3' ' CB ' ' A' ' 16' ' ' ASP . 1.0 OUTLIER -97.91 -38.28 9.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.814 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.26 84.88 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.049 -0.523 . . . . 1.0 111.448 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.13 -0.88 71.86 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.742 -0.742 . . . . 1.0 113.259 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.41 ' CB ' ' HB3' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -98.14 24.13 7.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.985 0.421 . . . . 1.0 110.65 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 172.63 0.03 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.035 -0.53 . . . . 1.0 111.052 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.6 t -64.62 -96.7 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.533 -0.303 . . . . 1.0 111.164 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.43 ' C ' ' H ' ' A' ' 21' ' ' LEU . 3.2 mm-40 -65.78 -164.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 N-CA-C 110.202 -0.296 . . . . 1.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.28 39.53 0.86 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.646 -0.788 . . . . 1.0 112.779 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.4 OUTLIER -69.82 155.14 40.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 120.819 0.343 . . . . 1.0 111.157 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.98 135.81 50.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.598 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.5 m -74.78 127.59 33.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.009 -0.541 . . . . 1.0 111.134 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 18.9 m0 -119.28 133.95 55.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.877 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -83.14 148.07 27.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.768 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.835 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -76.16 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.133 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.44 -59.45 2.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.464 . . . . 1.0 110.923 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.58 162.25 3.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.736 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -82.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.792 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -159.53 144.38 15.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 1.0 111.073 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.9 m -125.94 143.23 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.287 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 148.92 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.249 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.2 m -147.46 132.87 9.21 Favored Pre-proline 0 C--N 1.323 -0.562 0 C-N-CA 122.401 0.281 . . . . 1.0 111.245 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -57.27 136.37 75.9 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.875 2.383 . . . . 1.0 112.685 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -68.96 -45.7 70.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.02 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t -47.1 104.94 0.44 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.446 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.57 -157.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.757 2.305 . . . . 1.0 112.217 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 149.28 29.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.926 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.237 -0.887 . . . . 1.0 110.89 179.962 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.838 0.352 . . . . 1.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -60.14 149.58 32.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.876 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.98 163.71 11.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.223 -0.444 . . . . 1.0 111.307 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.421 HG22 ' HA ' ' A' ' 17' ' ' CYS . 8.0 tp -70.18 116.38 43.99 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 111.291 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.48 117.59 4.33 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.391 2.061 . . . . 1.0 111.885 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.62 169.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.18 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 25.4 m95 61.82 38.15 14.97 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.075 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.25 164.34 30.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.78 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.73 136.22 47.71 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.757 -0.735 . . . . 1.0 112.539 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.4 p -117.36 21.83 12.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.654 0.264 . . . . 1.0 111.275 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.05 87.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.901 0.381 . . . . 1.0 111.101 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -176.84 78.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 70.75 5.18 5.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.83 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 44.24 83.04 0.03 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.015 0.436 . . . . 1.0 111.412 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.25 10.29 1.96 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.67 -0.776 . . . . 1.0 113.143 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.89 11.84 23.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.226 0.513 . . . . 1.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.421 ' HA ' HG22 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -57.76 179.63 0.06 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 1.0 110.891 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.8 t -68.99 -95.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.692 -0.231 . . . . 1.0 111.036 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 -155.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.212 -0.292 . . . . 1.0 110.212 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.76 34.71 2.31 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.725 -0.75 . . . . 1.0 112.784 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 152.77 44.46 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 120.781 0.324 . . . . 1.0 111.023 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -116.85 158.39 24.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.917 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.0 m -86.69 113.85 22.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.902 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.441 ' CG ' HG12 ' A' ' 34' ' ' VAL . 18.8 m0 -108.4 136.4 48.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.822 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -88.18 150.85 23.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.037 0.446 . . . . 1.0 110.948 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -110.39 122.58 48.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.679 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -46.31 -40.5 11.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.275 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -92.51 -75.94 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -176.11 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.153 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -149.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 1.0 110.728 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.33 176.1 7.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.764 0.316 . . . . 1.0 110.677 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -170.11 144.81 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.451 -0.341 . . . . 1.0 111.388 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 153.63 40.03 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.96 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.441 HG12 ' CG ' ' A' ' 24' ' ' TRP . 7.1 p -146.53 137.23 12.48 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 116.727 -0.215 . . . . 1.0 111.547 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -61.36 145.79 97.91 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.953 2.435 . . . . 1.0 112.464 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -131.54 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.331 -0.395 . . . . 1.0 110.48 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 68.5 m -70.27 143.56 91.06 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.614 0.245 . . . . 1.0 110.878 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -88.45 -49.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 122.71 2.273 . . . . 1.0 112.864 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -55.84 112.88 1.28 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.489 -0.323 . . . . 1.0 111.102 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.198 -0.906 . . . . 1.0 110.798 179.935 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 121.162 0.506 . . . . 1.0 111.171 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.5 p-10 -60.18 118.03 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.812 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.2 177.11 0.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.178 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.6 pp -58.15 161.23 7.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.515 -0.311 . . . . 1.0 111.375 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -81.97 112.16 2.29 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.019 2.479 . . . . 1.0 111.774 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 pttt -58.3 155.48 11.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.918 0.389 . . . . 1.0 111.163 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.4 m95 60.38 43.38 13.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.349 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp -142.6 170.16 16.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.838 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.94 162.85 6.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.77 -0.729 . . . . 1.0 112.607 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.407 ' O ' ' N ' ' A' ' 12' ' ' ASN . 3.2 m -127.03 19.23 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.426 0.155 . . . . 1.0 111.302 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 t -57.42 85.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.78 0.324 . . . . 1.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 10' ' ' CYS . 30.4 t-20 179.76 80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 1.0 110.526 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 68.28 13.59 9.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.264 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.94 37.1 4.55 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.406 -0.361 . . . . 1.0 111.455 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 174.15 37.23 0.04 OUTLIER Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.999 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.8 15.04 29.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.531 0.205 . . . . 1.0 110.962 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.12 174.86 4.99 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.587 -0.278 . . . . 1.0 110.655 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.401 ' HB3' HD11 ' A' ' 21' ' ' LEU . 51.3 t -70.03 -105.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.753 -0.203 . . . . 1.0 111.045 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.23 -161.47 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.163 -0.31 . . . . 1.0 110.163 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.48 39.41 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.413 -0.899 . . . . 1.0 112.87 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 18' ' ' CYS . 0.2 OUTLIER -70.01 147.95 49.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.823 0.344 . . . . 1.0 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.03 153.56 32.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.003 0.43 . . . . 1.0 110.647 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.19 114.37 26.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.282 -0.417 . . . . 1.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -103.47 129.8 50.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.075 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -84.64 134.66 34.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.704 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -163.55 0.85 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.353 . . . . 1.0 110.641 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -79.7 0.06 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.636 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.47 -39.25 10.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.593 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.97 167.99 4.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.846 -0.616 . . . . 1.0 111.024 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -156.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -107.35 155.08 20.39 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.828 0.346 . . . . 1.0 110.721 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.18 138.57 33.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.315 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.65 155.26 16.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.9 p -155.28 116.72 2.36 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.024 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.0 137.76 77.89 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.764 2.309 . . . . 1.0 112.596 -179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.2 -67.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.907 -0.588 . . . . 1.0 111.436 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.7 t -70.44 147.81 95.12 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.543 -0.298 . . . . 1.0 111.075 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.23 -64.27 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.822 2.348 . . . . 1.0 112.151 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.49 114.28 3.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.966 -0.561 . . . . 1.0 111.001 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.4 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.073 -0.965 . . . . 1.0 110.861 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.953 0.406 . . . . 1.0 111.096 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.5 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.164 -0.471 . . . . 1.0 111.21 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.5 m -69.76 143.75 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.433 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -70.1 144.7 93.0 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.402 -0.363 . . . . 1.0 111.287 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -55.11 140.71 80.65 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.382 2.055 . . . . 1.0 112.052 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 18.0 pttt -96.02 30.81 2.3 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.996 0.427 . . . . 1.0 111.198 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 8.6 m95 -148.21 29.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.754 -0.657 . . . . 1.0 110.737 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.9 mmtm -118.68 161.69 19.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.385 . . . . 1.0 110.999 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' A' ' 31' ' ' GLU . . . -54.71 -179.16 0.18 Allowed Glycine 0 C--N 1.329 0.163 0 C-N-CA 121.053 -0.594 . . . . 1.0 112.434 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -131.86 11.03 4.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 111.607 0.225 . . . . 1.0 111.607 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.44 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 13.0 p -77.32 55.07 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.949 0.404 . . . . 1.0 111.092 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 51.5 t-20 172.96 -36.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.111 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mmt-85 -81.46 -52.18 7.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.779 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 51.43 67.05 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.121 0.486 . . . . 1.0 110.937 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.55 26.08 66.3 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.813 -0.708 . . . . 1.0 112.271 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.77 23.43 11.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.619 0.247 . . . . 1.0 110.919 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 21' ' ' LEU . 3.5 m -58.65 167.56 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 1.0 110.388 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -60.31 -85.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.531 -179.775 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.432 ' N ' ' SG ' ' A' ' 18' ' ' CYS . 22.9 mt-10 -70.34 -161.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.06 37.76 1.32 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.373 -0.918 . . . . 1.0 112.342 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.3 OUTLIER -70.0 154.2 42.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.069 0.461 . . . . 1.0 110.95 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.506 ' HG3' ' CD1' ' A' ' 24' ' ' TRP . 0.5 OUTLIER -109.72 149.86 29.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.315 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.25 98.74 9.97 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 1.0 110.537 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.506 ' CD1' ' HG3' ' A' ' 22' ' ' GLU . 42.6 m0 -76.74 133.55 39.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 1.0 111.131 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -84.56 165.82 17.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.777 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 148.79 35.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.696 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -56.12 -54.57 43.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.995 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 mtp85 -70.32 -80.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 1.0 110.624 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 p -70.12 163.04 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.765 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.417 ' CZ ' HG13 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -57.59 -80.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.657 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.41 ' O ' ' HA2' ' A' ' 9' ' ' GLY . 18.2 mt-10 -154.82 -167.97 2.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.743 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.3 p -170.28 142.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 1.0 111.027 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.8 m -67.01 159.99 27.47 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.502 -0.317 . . . . 1.0 110.621 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.418 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.7 p -173.18 137.55 0.77 Allowed Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 111.613 0.227 . . . . 1.0 111.613 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.01 140.86 97.23 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.955 2.437 . . . . 1.0 112.418 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -60.34 -78.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 80.0 m -70.21 107.89 2.88 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.347 -0.388 . . . . 1.0 110.792 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 9.2 Cg_endo -88.16 -77.87 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.229 0 C-N-CA 122.976 2.45 . . . . 1.0 112.333 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 124.09 23.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.404 -0.362 . . . . 1.0 110.927 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.206 -0.902 . . . . 1.0 110.843 179.954 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.801 0.334 . . . . 1.0 111.268 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.17 74.13 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.127 -0.488 . . . . 1.0 111.221 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.0 157.51 36.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.756 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.591 HG21 ' HA ' ' A' ' 17' ' ' CYS . 0.5 OUTLIER -70.14 117.6 55.85 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.081 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.8 171.78 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.633 2.222 . . . . 1.0 112.852 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 34.0 pttt -87.39 50.45 2.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.927 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.441 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.0 m95 -147.99 29.32 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.433 -0.349 . . . . 1.0 111.1 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.6 tmtm? -116.69 137.98 51.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.27 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -50.18 144.87 9.93 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.997 -0.62 . . . . 1.0 112.671 -179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 p -109.99 7.34 23.67 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.755 0.28 . . . . 1.0 111.755 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.432 HG23 ' CE2' ' A' ' 30' ' ' PHE . 34.8 t -61.95 138.22 22.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.538 0.209 . . . . 1.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.502 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.1 t-20 68.88 84.53 0.15 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.207 0.527 . . . . 1.0 109.629 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 1.2 mmm180 76.39 82.32 0.09 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.075 -0.966 . . . . 1.0 109.845 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -67.48 49.74 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.986 -1.006 . . . . 1.0 111.897 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -160.66 22.26 0.24 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 121.169 -0.539 . . . . 1.0 112.356 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -6.86 59.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.616 0.246 . . . . 1.0 110.982 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.613 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 2.9 t -69.73 -159.81 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.788 -0.449 . . . . 1.0 109.788 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.469 ' N ' ' CG2' ' A' ' 4' ' ' ILE . 42.3 t -70.31 -105.29 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.15 0.426 . . . . 1.0 112.15 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.566 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -70.43 -160.46 0.04 OUTLIER 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.566 0.222 . . . . 1.0 110.851 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.18 47.67 2.66 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.313 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.613 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -69.4 144.15 53.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.915 0.388 . . . . 1.0 110.763 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.5 165.68 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.232 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.27 107.2 17.7 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.851 -0.613 . . . . 1.0 110.571 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -102.22 126.97 49.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.83 145.05 29.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.619 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -107.02 123.08 47.68 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -46.31 -29.88 1.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.025 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.57 -70.99 0.73 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.74 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.8 p -70.15 179.59 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.954 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.432 ' CE2' HG23 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -69.96 -155.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.967 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -99.24 -178.47 3.93 Favored 'General case' 0 N--CA 1.458 -0.071 0 CA-C-N 116.614 -0.267 . . . . 1.0 110.535 179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.441 ' CG2' ' HA ' ' A' ' 7' ' ' TRP . 4.8 p -170.21 157.39 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.811 0.339 . . . . 1.0 111.82 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.5 p -99.54 117.63 34.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.789 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.5 p -109.32 117.27 53.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.68 -0.236 . . . . 1.0 111.61 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.424 ' HD3' ' HB3' ' A' ' 6' ' ' LYS . 29.1 Cg_endo -59.79 132.08 43.32 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.843 2.362 . . . . 1.0 113.14 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -70.71 -47.18 61.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.598 -0.728 . . . . 1.0 110.654 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.9 t -60.86 155.85 50.37 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.959 -0.564 . . . . 1.0 110.998 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -68.09 145.46 67.21 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.693 2.262 . . . . 1.0 112.187 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -177.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.269 -0.423 . . . . 1.0 111.037 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 73.8 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.267 -0.873 . . . . 1.0 110.965 -179.851 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.84 0.352 . . . . 1.0 111.129 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.86 77.55 0.08 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.98 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 m -59.43 172.67 0.62 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.061 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -69.96 140.55 88.72 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.265 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -62.2 149.96 88.62 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.391 2.06 . . . . 1.0 112.03 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.463 ' HB3' ' CD1' ' A' ' 7' ' ' TRP . 17.4 mtmm -60.53 165.69 3.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 1.0 110.955 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.463 ' CD1' ' HB3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 46.91 69.98 0.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.067 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' HD3' ' N ' ' A' ' 9' ' ' GLY . 4.4 tmtm? -129.46 132.15 46.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.839 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.412 ' N ' ' HD3' ' A' ' 8' ' ' LYS . . . -48.94 139.74 12.58 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 121.235 -0.507 . . . . 1.0 112.811 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.8 p -106.04 -3.22 21.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.511 0.196 . . . . 1.0 111.396 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t -83.25 64.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.827 0.346 . . . . 1.0 111.373 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.41 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 1.4 p30 -153.89 -86.87 0.06 Allowed 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.855 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 -88.15 -11.89 45.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.597 0.237 . . . . 1.0 111.32 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 53.81 79.22 0.13 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.0 0.429 . . . . 1.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.67 6.82 6.45 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.818 -0.705 . . . . 1.0 112.743 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -69.89 -13.98 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.991 0.395 . . . . 1.0 111.034 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.428 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 84.8 m -59.23 142.49 51.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.589 -0.278 . . . . 1.0 110.501 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.433 ' HB3' HD12 ' A' ' 21' ' ' LEU . 46.4 t -56.98 -103.36 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.428 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.402 ' N ' HD12 ' A' ' 21' ' ' LEU . 17.0 mm-40 -63.97 -157.19 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.079 -0.341 . . . . 1.0 110.079 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.82 42.4 2.04 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.521 -0.847 . . . . 1.0 112.935 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.433 HD12 ' HB3' ' A' ' 18' ' ' CYS . 0.2 OUTLIER -71.68 148.67 46.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.8 0.333 . . . . 1.0 110.894 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -123.84 148.85 46.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.186 0.517 . . . . 1.0 110.856 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 6.8 p -90.79 119.07 30.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.089 -0.505 . . . . 1.0 111.47 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' OE1' ' A' ' 22' ' ' GLU . 35.8 m0 -101.09 125.67 47.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.716 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -73.78 136.51 43.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 1.0 110.475 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.99 -168.45 1.46 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.331 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -46.92 87.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.622 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.71 -42.3 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.636 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.3 t -59.07 173.03 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.011 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -167.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.366 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.26 146.24 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.457 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.431 ' HB ' ' HA ' ' A' ' 7' ' ' TRP . 3.9 m -128.36 137.64 56.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.953 0.406 . . . . 1.0 111.377 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -61.77 146.49 49.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.145 -0.479 . . . . 1.0 111.521 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.8 p -147.12 127.17 6.73 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.896 -0.593 . . . . 1.0 110.831 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -56.91 131.12 43.58 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.877 2.385 . . . . 1.0 112.929 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 ptmm? -70.14 -100.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.728 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.41 ' CG2' ' CD ' ' A' ' 38' ' ' PRO . 84.5 m -70.48 149.89 95.62 Favored Pre-proline 0 C--N 1.333 -0.144 0 CA-C-O 120.485 0.183 . . . . 1.0 110.667 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' CD ' ' CG2' ' A' ' 37' ' ' THR . 1.0 OUTLIER -84.2 42.34 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.975 2.45 . . . . 1.0 112.815 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 110.56 5.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.855 0.36 . . . . 1.0 110.768 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 C--O 1.244 0.81 0 CA-C-O 118.37 -0.824 . . . . 1.0 110.727 179.907 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.846 0.355 . . . . 1.0 111.206 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.52 118.35 6.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.173 -0.467 . . . . 1.0 111.077 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -62.17 172.79 1.31 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 1.0 111.04 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.412 HG12 ' HA ' ' A' ' 17' ' ' CYS . 1.4 pp -70.13 157.82 88.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.264 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -75.12 120.01 5.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.781 2.321 . . . . 1.0 111.928 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' C ' ' CG ' ' A' ' 7' ' ' TRP . 12.1 mttt -51.11 148.02 4.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 1.0 111.363 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.44 ' CG ' ' C ' ' A' ' 6' ' ' LYS . 0.7 OUTLIER 44.04 68.94 0.46 Allowed 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 115.859 -0.61 . . . . 1.0 111.98 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.2 mmtt -148.28 173.81 12.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 1.0 110.831 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -48.31 152.46 2.34 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 121.034 -0.603 . . . . 1.0 112.771 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.445 ' HB2' ' HB2' ' A' ' 31' ' ' GLU . 62.6 m -96.54 0.51 50.21 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.59 0.219 . . . . 1.0 111.59 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -49.79 89.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 120.936 0.398 . . . . 1.0 111.182 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.6 t-20 173.61 84.49 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 1.0 109.997 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.11 27.71 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 42.71 32.79 0.41 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.948 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.09 37.58 0.04 OUTLIER Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.131 -1.033 . . . . 1.0 113.195 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -107.41 14.75 25.62 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.679 0.276 . . . . 1.0 110.611 179.47 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.496 ' HB3' HD12 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -57.1 177.23 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.655 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.421 ' HB3' HD11 ' A' ' 21' ' ' LEU . 50.3 t -70.17 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.029 -0.268 . . . . 1.0 111.524 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' N ' HD13 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.66 -152.25 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.614 0.245 . . . . 1.0 110.745 179.831 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.96 37.38 2.52 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.707 -0.759 . . . . 1.0 112.788 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.519 HD13 ' N ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -69.86 145.03 52.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.009 0.433 . . . . 1.0 110.726 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -91.7 159.44 15.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.702 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.58 114.46 27.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.864 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.5 m0 -99.28 101.17 12.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.87 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 140.27 36.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 1.0 110.762 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -105.27 117.33 33.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.484 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -45.93 -31.5 2.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.108 -0.496 . . . . 1.0 111.221 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mmt-85 -85.88 -86.62 0.14 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.631 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.0 t -70.39 -164.16 0.08 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.833 0.349 . . . . 1.0 110.856 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -154.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.484 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 10' ' ' CYS . 23.5 mt-10 -109.59 175.64 5.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.666 -0.243 . . . . 1.0 110.368 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.2 t -152.79 139.38 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 1.0 111.706 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 151.46 21.48 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.958 -0.565 . . . . 1.0 110.409 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 1.8 m -145.25 122.52 6.25 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 111.642 0.238 . . . . 1.0 111.642 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -61.96 142.09 91.7 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.24 2.627 . . . . 1.0 112.54 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.221 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.4 t -69.78 150.11 96.6 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.602 -0.272 . . . . 1.0 111.254 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -73.47 -154.04 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.745 2.297 . . . . 1.0 112.166 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -52.76 106.16 0.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 1.0 110.978 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.176 -0.916 . . . . 1.0 111.039 -179.976 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.816 0.341 . . . . 1.0 111.352 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -59.11 87.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 1.0 110.967 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.93 155.54 19.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.159 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.426 ' HB ' ' CD ' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -69.71 172.07 6.11 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.426 ' CD ' ' HB ' ' A' ' 4' ' ' ILE . 13.3 Cg_exo -68.77 116.16 4.3 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.672 2.248 . . . . 1.0 111.851 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -88.99 39.81 0.95 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.268 -179.68 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.428 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 43.1 m95 -150.22 22.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.0 110.666 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 mmtm -115.6 158.5 22.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.028 0.442 . . . . 1.0 111.07 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.0 173.67 0.59 Allowed Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.792 -0.64 . . . . 1.0 113.092 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 t -106.55 -2.76 21.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.585 0.231 . . . . 1.0 111.514 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.7 p -76.88 60.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.944 0.402 . . . . 1.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -178.64 -56.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 1.0 110.728 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -48.19 18.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.17 32.05 10.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.938 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 111.56 4.78 26.52 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.902 -0.666 . . . . 1.0 112.539 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -0.83 50.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.828 0.314 . . . . 1.0 111.312 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.0 m -53.35 170.57 0.09 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.682 -0.235 . . . . 1.0 110.761 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.491 ' C ' HD13 ' A' ' 21' ' ' LEU . 21.8 p -63.43 -123.94 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 121.231 -0.188 . . . . 1.0 111.451 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 21' ' ' LEU . 1.1 mt-10 -46.77 91.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 112.866 0.691 . . . . 1.0 112.866 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' GLU . . . 18.15 45.61 0.01 OUTLIER Glycine 0 C--N 1.337 0.608 0 CA-C-N 114.962 -1.017 . . . . 1.0 115.452 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 19' ' ' GLU . 3.0 mp -68.83 161.05 29.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 117.207 0.503 . . . . 1.0 110.894 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -132.89 133.74 43.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.428 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 8.1 p -84.51 115.56 22.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.08 0.467 . . . . 1.0 111.127 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.402 ' CD2' HG22 ' A' ' 34' ' ' VAL . 52.0 m0 -90.19 134.21 34.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.591 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 142.86 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.955 0.407 . . . . 1.0 110.956 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -115.66 135.43 54.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 1.0 110.464 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.98 -50.43 19.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.672 -0.694 . . . . 1.0 111.433 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -89.04 -71.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.19 173.99 6.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.751 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -146.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.516 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -107.63 131.47 54.35 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 110.447 -0.205 . . . . 1.0 110.447 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 23.4 m -115.41 138.57 45.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.632 0.254 . . . . 1.0 111.625 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -66.01 147.12 53.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.545 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.402 HG22 ' CD2' ' A' ' 24' ' ' TRP . 2.4 m -149.92 125.13 4.84 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -56.61 132.79 53.9 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.768 2.312 . . . . 1.0 112.943 -179.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -70.26 -111.31 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.761 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -70.38 116.33 43.95 Favored Pre-proline 0 CA--C 1.531 0.232 0 O-C-N 122.297 -0.252 . . . . 1.0 111.028 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -71.62 175.81 9.02 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.726 2.284 . . . . 1.0 112.187 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.3 -73.41 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.432 . . . . 1.0 110.807 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.8 m . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.374 -0.822 . . . . 1.0 111.032 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.79 0.329 . . . . 1.0 111.214 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.43 129.06 39.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.848 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.59 155.46 9.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.198 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.416 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.4 pp -63.73 140.38 97.8 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.635 -0.257 . . . . 1.0 111.186 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.0 148.15 93.65 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.528 2.152 . . . . 1.0 112.303 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -95.19 38.51 1.13 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.885 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -156.86 27.99 0.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.701 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.14 166.54 13.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.49 35.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.725 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.96 26.73 8.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.709 0.29 . . . . 1.0 110.979 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.425 HG21 ' CE2' ' A' ' 30' ' ' PHE . 22.0 t -100.6 71.88 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.142 0.496 . . . . 1.0 111.091 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -176.83 -62.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 1.0 110.613 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.68 -46.3 22.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 55.7 87.2 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.05 -12.8 9.77 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.386 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -11.67 61.07 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.642 0.258 . . . . 1.0 111.185 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.437 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.3 m -48.44 144.83 3.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.708 -0.224 . . . . 1.0 110.55 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.3 t -59.61 -102.6 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.218 -0.193 . . . . 1.0 111.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.3 -157.59 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 N-CA-C 110.291 -0.263 . . . . 1.0 110.291 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.17 43.12 2.44 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.508 -0.854 . . . . 1.0 112.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.437 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.71 148.72 48.87 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 120.972 0.415 . . . . 1.0 111.216 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -111.76 151.05 29.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 1.0 111.29 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.2 m -78.17 120.21 22.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.673 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.419 ' CD2' HG13 ' A' ' 34' ' ' VAL . 6.9 m0 -119.02 139.37 51.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.863 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -81.67 147.39 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.963 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -120.02 138.81 53.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.104 0.478 . . . . 1.0 110.543 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.12 -57.93 7.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 1.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -71.91 0.42 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.724 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.99 170.3 8.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.845 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.425 ' CE2' HG21 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.24 -145.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.112 -0.495 . . . . 1.0 110.935 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -97.21 126.63 42.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.781 0.324 . . . . 1.0 110.769 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 27.6 m -124.15 152.21 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 116.343 -0.389 . . . . 1.0 111.563 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.19 149.05 37.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.215 -0.448 . . . . 1.0 111.173 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.419 HG13 ' CD2' ' A' ' 24' ' ' TRP . 10.8 p -148.58 137.34 11.86 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.527 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -56.58 138.27 84.04 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.954 2.436 . . . . 1.0 112.484 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -102.76 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.135 -0.484 . . . . 1.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 63.1 m -70.05 109.25 4.45 Favored Pre-proline 0 C--O 1.232 0.158 0 CA-C-O 120.494 0.188 . . . . 1.0 111.126 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -74.42 149.69 40.02 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 122.719 2.279 . . . . 1.0 112.167 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.7 171.11 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.883 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 69.9 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.233 -0.889 . . . . 1.0 110.917 -179.991 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.771 0.319 . . . . 1.0 111.17 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.42 132.7 48.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.922 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.483 ' HA ' ' HB3' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -60.67 141.6 56.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.745 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.1 pt -60.0 157.48 30.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.503 -0.317 . . . . 1.0 110.648 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.425 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 52.5 Cg_exo -53.46 96.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 122.385 2.057 . . . . 1.0 112.002 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.76 151.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.29 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.41 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 38.6 m0 63.4 49.88 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.231 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 5' ' ' PRO . 1.5 tptp -117.04 152.76 33.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 1.0 110.809 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.43 158.23 23.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.681 -0.771 . . . . 1.0 112.22 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -3.49 45.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.528 0.204 . . . . 1.0 111.325 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -69.02 69.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.908 0.385 . . . . 1.0 110.843 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.6 t-20 -177.97 80.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.054 -0.521 . . . . 1.0 110.506 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.8 OUTLIER 68.22 12.12 8.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.572 . . . . 1.0 111.351 -179.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 42.34 79.43 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.859 0.361 . . . . 1.0 111.511 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.81 46.01 0.62 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -96.45 23.79 6.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.906 0.384 . . . . 1.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.426 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.2 m -70.11 144.56 52.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.403 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.525 ' N ' ' CD1' ' A' ' 21' ' ' LEU . 1.6 p -55.71 -105.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.568 -0.287 . . . . 1.0 111.748 -179.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.607 ' N ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -57.28 -155.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.644 0.259 . . . . 1.0 110.812 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -71.49 32.02 0.58 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.766 -0.731 . . . . 1.0 114.429 -178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.607 HD12 ' N ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -73.13 140.06 46.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.744 0.772 . . . . 1.0 110.186 179.143 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -108.66 162.89 13.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.906 0.384 . . . . 1.0 111.158 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.85 100.38 13.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.729 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 25.7 m0 -100.35 144.64 29.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.073 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.56 133.26 39.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.721 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.97 -172.25 2.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.012 0.434 . . . . 1.0 110.759 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -70.27 -71.52 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.811 -0.632 . . . . 1.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -70.88 -76.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.038 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -58.85 147.49 33.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 1.0 110.835 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.0 110.497 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.64 137.72 51.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.775 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.419 HG22 ' N ' ' A' ' 33' ' ' CYS . 11.2 p -132.8 145.27 34.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.373 -0.376 . . . . 1.0 111.268 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.419 ' N ' HG22 ' A' ' 32' ' ' VAL . 53.4 m -61.8 137.27 58.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.961 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.52 126.93 7.62 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.801 -0.182 . . . . 1.0 111.348 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -59.53 141.85 97.96 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.92 2.413 . . . . 1.0 112.486 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -49.79 -62.68 1.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.041 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.424 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 75.5 m -69.8 138.23 87.97 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.686 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 47.8 Cg_endo -93.77 66.07 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.644 2.23 . . . . 1.0 112.331 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -66.59 75.79 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.455 . . . . 1.0 110.848 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.7 m . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.219 -0.896 . . . . 1.0 110.921 179.999 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.768 0.318 . . . . 1.0 111.133 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.76 93.93 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.15 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HB2' ' HA ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -70.42 -169.84 0.34 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.748 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.6 pp -51.9 141.29 28.27 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 1.0 111.66 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -80.08 158.79 23.74 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.787 2.325 . . . . 1.0 111.862 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -62.04 161.5 10.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.952 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.437 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 42.6 m0 62.78 48.06 4.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.921 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -130.03 142.32 50.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.31 175.81 2.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 1.0 112.641 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.9 t -104.95 1.88 29.21 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.576 0.214 . . . . 1.0 111.576 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.0 p -67.39 68.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 CA-C-O 121.124 0.488 . . . . 1.0 111.11 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -169.95 76.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.591 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 75.61 7.17 3.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.245 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 49.04 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.317 . . . . 1.0 111.35 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.4 38.8 1.07 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.962 -0.637 . . . . 1.0 112.495 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.91 20.42 13.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.649 0.262 . . . . 1.0 111.252 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.4 m -55.39 147.3 17.54 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.561 0.219 . . . . 1.0 110.562 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 42.4 t -61.84 -96.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.617 -0.265 . . . . 1.0 110.939 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -154.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.028 -0.36 . . . . 1.0 110.028 179.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.47 33.43 1.59 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.594 -0.812 . . . . 1.0 112.896 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -78.62 157.08 28.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.909 0.385 . . . . 1.0 111.042 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -132.2 126.24 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.347 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 13.2 p -69.48 109.69 4.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.084 0.469 . . . . 1.0 111.115 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.418 ' CE3' HG22 ' A' ' 34' ' ' VAL . 51.2 m0 -97.4 143.74 27.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.861 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -67.5 146.89 53.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 1.0 110.895 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -128.01 -177.75 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.575 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -78.51 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.898 -0.592 . . . . 1.0 111.229 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.39 -73.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.331 -0.395 . . . . 1.0 111.12 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -65.59 168.21 7.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.45 -0.341 . . . . 1.0 110.95 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -81.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.42 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -153.39 136.38 15.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.31 -0.404 . . . . 1.0 110.64 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.2 m -121.13 141.63 40.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.36 -0.382 . . . . 1.0 111.487 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 79.6 m -58.79 133.35 55.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.02 -0.537 . . . . 1.0 111.323 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.418 HG22 ' CE3' ' A' ' 24' ' ' TRP . 5.2 m -137.66 133.32 17.83 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.028 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.2 136.94 75.55 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.971 2.448 . . . . 1.0 112.403 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -51.21 -47.05 62.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.8 m -69.57 109.74 5.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.87 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.42 -161.28 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.626 2.217 . . . . 1.0 112.187 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.56 129.99 43.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.976 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 83.2 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.243 -0.885 . . . . 1.0 110.731 -179.897 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.776 0.322 . . . . 1.0 111.279 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -59.26 105.43 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 1.0 111.217 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.19 153.08 41.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.463 . . . . 1.0 111.18 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.437 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.3 pp -70.3 143.34 90.69 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.4 -0.364 . . . . 1.0 111.258 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 3.0 Cg_exo -73.65 140.36 29.4 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.553 2.169 . . . . 1.0 111.661 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.487 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 1.0 OUTLIER -55.52 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.984 0.421 . . . . 1.0 111.103 -179.848 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.487 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 48.0 p-90 41.14 32.34 0.18 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.748 -0.66 . . . . 1.0 111.344 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.83 143.93 31.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 1.0 111.066 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.58 152.49 51.53 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.574 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.9 m -86.13 -4.74 59.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.641 0.258 . . . . 1.0 111.417 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.51 72.5 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.957 0.408 . . . . 1.0 110.953 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -176.23 78.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.974 -0.557 . . . . 1.0 110.826 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 74.63 4.33 4.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.642 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 47.13 83.93 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.761 0.315 . . . . 1.0 111.247 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.49 38.21 0.6 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.662 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.97 10.11 42.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.507 0.194 . . . . 1.0 111.295 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.461 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 10.0 m -65.9 152.24 44.93 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.656 -0.247 . . . . 1.0 110.534 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.22 -100.64 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.769 -0.196 . . . . 1.0 111.048 -179.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -70.13 -161.65 0.05 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.467 0.175 . . . . 1.0 110.558 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.45 47.88 2.12 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.609 -0.805 . . . . 1.0 112.192 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.461 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -70.08 151.1 45.88 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.968 0.413 . . . . 1.0 111.069 -179.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.94 142.9 26.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.988 -0.551 . . . . 1.0 111.222 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 23.0 t -89.24 103.32 15.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.986 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -81.22 90.09 6.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.75 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.96 133.97 33.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.264 0.554 . . . . 1.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -99.12 117.9 34.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.947 -0.57 . . . . 1.0 110.649 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 -43.27 -31.91 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.369 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -59.14 1.99 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.353 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.06 -179.81 2.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.012 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.08 -166.74 0.13 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.009 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -113.14 160.25 18.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.589 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -160.05 131.42 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.582 -0.281 . . . . 1.0 111.207 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.48 149.33 28.79 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.397 -0.365 . . . . 1.0 111.127 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.7 p -145.35 136.48 12.52 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 1.0 111.287 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -58.87 138.63 86.78 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.201 2.601 . . . . 1.0 112.625 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.458 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -69.72 -40.01 76.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.159 -0.473 . . . . 1.0 111.076 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.458 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.4 m -64.84 130.88 95.0 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.145 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 58.2 Cg_endo -93.39 99.22 0.15 Allowed 'Trans proline' 0 N--CA 1.445 -1.324 0 C-N-CA 123.095 2.53 . . . . 1.0 112.373 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -59.59 -74.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.116 -0.945 . . . . 1.0 111.01 179.872 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.946 0.403 . . . . 1.0 111.337 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.15 93.36 0.2 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.99 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 4.1 m -70.29 -84.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.018 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.2 pp -70.52 158.13 88.47 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.273 . . . . 1.0 111.263 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -59.63 98.37 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.434 2.09 . . . . 1.0 111.646 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -46.33 134.49 8.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.003 0.43 . . . . 1.0 111.576 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 28.3 m0 64.29 75.68 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.173 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -156.5 174.55 15.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.61 179.55 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -55.31 132.13 49.04 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.847 -0.692 . . . . 1.0 112.791 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -98.61 23.64 8.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.623 0.249 . . . . 1.0 111.217 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' CD2' ' A' ' 30' ' ' PHE . 20.1 t -75.62 77.75 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.939 0.4 . . . . 1.0 110.972 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -176.9 78.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 73.6 5.32 4.9 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.211 -0.449 . . . . 1.0 111.691 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.98 34.52 2.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.629 0.252 . . . . 1.0 111.383 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 179.46 35.79 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.411 -0.9 . . . . 1.0 112.816 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.28 14.68 31.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 1.0 110.938 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -70.08 167.62 17.28 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.464 -0.335 . . . . 1.0 111.036 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.52 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 42.0 t -67.47 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.236 -0.438 . . . . 1.0 111.45 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -155.12 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.56 0.219 . . . . 1.0 110.639 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.25 34.6 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.618 -0.801 . . . . 1.0 113.282 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.67 150.24 47.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.9 0.35 . . . . 1.0 110.671 179.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -126.3 144.27 50.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.066 0.46 . . . . 1.0 111.112 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.4 m -73.88 124.47 26.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.839 -0.619 . . . . 1.0 110.782 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.427 ' CG ' HG11 ' A' ' 34' ' ' VAL . 22.3 m0 -113.73 122.98 48.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.899 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -57.47 150.94 17.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.001 0.429 . . . . 1.0 110.92 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.07 141.53 48.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.547 . . . . 1.0 110.592 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -41.5 66.64 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 1.0 111.134 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.49 -81.97 0.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.785 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.83 -179.84 1.97 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.758 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -69.96 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.52 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 mp0 -140.82 140.25 34.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 1.0 110.753 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -122.98 129.12 75.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 1.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 149.49 40.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.221 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG11 ' CG ' ' A' ' 24' ' ' TRP . 11.5 p -147.45 123.59 5.46 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.441 -0.345 . . . . 1.0 111.364 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.23 138.59 85.74 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.61 2.207 . . . . 1.0 112.651 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -30.2 70.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.892 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.2 m -68.07 148.77 98.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.97 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -85.51 124.62 2.76 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.908 2.406 . . . . 1.0 112.236 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.78 121.38 14.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 1.0 110.817 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.229 -0.891 . . . . 1.0 110.852 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.912 0.387 . . . . 1.0 111.17 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.25 105.42 0.41 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.175 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.13 178.37 2.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.861 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -70.18 158.6 87.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.848 0.356 . . . . 1.0 110.946 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -61.12 93.76 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.476 2.117 . . . . 1.0 112.23 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -61.72 146.68 48.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.787 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 35.3 m95 61.69 38.48 15.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.075 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.8 mmtm -131.07 -176.14 3.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.879 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.49 -170.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.655 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.41 ' O ' ' ND1' ' A' ' 14' ' ' HIS . 1.6 m -115.06 -4.74 12.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 111.606 0.224 . . . . 1.0 111.606 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 18.9 t -68.2 63.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.848 0.356 . . . . 1.0 111.389 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 56.9 t-20 174.34 83.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.329 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 mmm180 70.38 76.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.307 0.575 . . . . 1.0 110.427 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.41 ' ND1' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -72.14 51.11 0.23 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.302 -0.863 . . . . 1.0 111.338 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.6 -27.07 0.22 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.536 -0.84 . . . . 1.0 112.62 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.89 26.81 3.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.759 0.314 . . . . 1.0 110.997 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -49.91 176.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.053 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.406 ' N ' HD13 ' A' ' 21' ' ' LEU . 41.5 t -55.37 -101.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.671 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.499 ' O ' ' CG ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -70.78 75.5 0.61 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.924 0.392 . . . . 1.0 110.707 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 33.05 33.95 0.02 OUTLIER Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.92 -0.582 . . . . 1.0 113.546 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' A' ' 19' ' ' GLU . 0.2 OUTLIER -69.33 150.73 47.03 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 120.911 0.386 . . . . 1.0 111.181 -179.498 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -101.85 164.22 11.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.655 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.17 115.53 30.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.704 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.43 ' CD2' HG13 ' A' ' 34' ' ' VAL . 23.4 m0 -99.99 100.82 11.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.7 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.71 141.55 28.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.845 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 125.17 50.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.435 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -44.44 -30.18 0.82 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.414 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.3 -67.43 0.92 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.761 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p -69.24 179.31 2.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 1.0 111.118 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -162.23 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 1.0 111.249 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.43 139.12 53.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.54 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.4 m -133.03 163.69 37.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.279 -0.419 . . . . 1.0 111.167 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.45 150.5 21.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.933 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.43 HG13 ' CD2' ' A' ' 24' ' ' TRP . 11.6 p -150.84 137.28 11.22 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.998 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -58.67 140.28 94.27 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.993 2.462 . . . . 1.0 112.564 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -43.14 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.995 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.1 t -66.39 153.65 92.34 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -92.15 123.4 0.66 Allowed 'Trans proline' 0 N--CA 1.449 -1.1 0 C-N-CA 123.27 2.647 . . . . 1.0 112.233 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.7 86.45 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.999 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 76.2 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.127 -0.94 . . . . 1.0 110.929 179.92 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.998 0.428 . . . . 1.0 110.989 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.63 HD13 ' N ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER -70.08 121.11 81.93 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.102 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.96 141.22 93.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.22 1.947 . . . . 1.0 111.706 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 pttm -71.69 154.19 41.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.908 0.385 . . . . 1.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 20.5 m95 56.04 28.77 13.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.027 -0.533 . . . . 1.0 111.311 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.678 ' C ' HG12 ' A' ' 32' ' ' VAL . 2.0 tptt -109.85 152.59 25.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.417 . . . . 1.0 110.754 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.69 162.83 0.05 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.219 -0.515 . . . . 1.0 113.214 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.15 -8.58 35.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.547 0.213 . . . . 1.0 111.498 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.5 HG12 ' N ' ' A' ' 12' ' ' ASN . 22.0 t -41.19 159.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.473 -0.33 . . . . 1.0 111.413 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.5 ' N ' HG12 ' A' ' 11' ' ' VAL . 56.8 t-20 75.2 83.36 0.1 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.979 0.418 . . . . 1.0 110.285 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 12' ' ' ASN . 21.9 mmt-85 83.21 -16.71 0.55 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.482 -0.781 . . . . 1.0 112.07 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.61 87.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.796 0.332 . . . . 1.0 111.276 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.03 34.46 2.76 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.664 -0.779 . . . . 1.0 112.536 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.95 24.89 7.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.652 0.263 . . . . 1.0 111.048 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.2 m -42.91 150.45 0.16 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.056 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.2 t -70.13 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.91 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.438 ' N ' HD11 ' A' ' 21' ' ' LEU . 7.6 mt-10 -61.89 -154.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.231 -0.285 . . . . 1.0 110.231 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.55 28.46 2.08 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.753 -0.736 . . . . 1.0 112.941 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.798 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.77 144.19 52.76 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.715 0.293 . . . . 1.0 110.624 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.624 ' O ' HG22 ' A' ' 34' ' ' VAL . 9.8 pt-20 -106.65 137.15 45.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 1.0 111.002 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.95 112.4 20.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.992 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.465 ' CD2' HG21 ' A' ' 34' ' ' VAL . 31.4 m0 -95.1 122.13 37.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -84.8 133.86 34.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.871 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.64 -159.69 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.591 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -51.47 52.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.348 -0.387 . . . . 1.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.52 -43.11 1.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.905 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 p -57.53 177.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.15 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.401 ' CD1' ' N ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -66.04 -167.14 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.463 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -111.04 161.32 16.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.403 179.615 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.678 HG12 ' C ' ' A' ' 8' ' ' LYS . 2.0 m -131.74 127.66 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 1.0 111.179 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.6 m -61.73 127.4 31.24 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.768 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.624 HG22 ' O ' ' A' ' 22' ' ' GLU . 14.6 m -124.68 115.04 26.83 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.759 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.798 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.3 Cg_endo -59.16 134.52 59.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.622 2.215 . . . . 1.0 112.69 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.993 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.556 -0.293 . . . . 1.0 110.598 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.754 0.312 . . . . 1.0 111.282 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.754 HG22 ' HD2' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -70.34 147.66 95.25 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.721 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.754 ' HD2' HG22 ' A' ' 4' ' ' ILE . 1.7 Cg_endo -79.83 119.6 4.04 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.563 2.175 . . . . 1.0 111.461 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.89 145.23 46.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.896 0.379 . . . . 1.0 111.009 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 9.4 m95 59.7 49.21 8.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.997 -0.547 . . . . 1.0 111.501 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.713 ' O ' HG13 ' A' ' 32' ' ' VAL . 2.8 mmtp -141.89 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.868 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.48 145.36 1.34 Allowed Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.005 -0.543 . . . . 1.0 113.191 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -95.66 0.76 53.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.386 0.143 . . . . 1.0 111.386 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.511 HG22 ' CE2' ' A' ' 30' ' ' PHE . 21.7 t -53.58 86.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 120.977 0.418 . . . . 1.0 111.559 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.1 t-20 175.41 81.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.415 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 mmt-85 68.57 10.58 7.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.19 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 45.98 71.19 0.31 Allowed 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.899 0.381 . . . . 1.0 111.445 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 123.95 40.75 0.44 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.62 -0.8 . . . . 1.0 113.012 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -100.46 23.02 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.427 0.156 . . . . 1.0 110.931 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 29.8 m -47.25 151.83 0.66 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.642 -0.254 . . . . 1.0 110.889 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.41 ' N ' HG12 ' A' ' 4' ' ' ILE . 28.3 t -67.81 -97.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.15 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' HG3' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.87 -155.03 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.214 -0.291 . . . . 1.0 110.214 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.88 31.37 0.75 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.651 -0.785 . . . . 1.0 114.346 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.674 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -78.16 147.14 34.67 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 117.591 0.696 . . . . 1.0 110.603 179.358 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -102.85 150.82 23.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.0 t -91.19 112.41 24.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.0 m0 -105.68 163.66 12.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.988 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.7 ptmt -116.68 151.71 35.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.911 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.41 126.09 53.08 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.591 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -38.67 4.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.946 -0.57 . . . . 1.0 111.074 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.78 -68.11 0.83 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.902 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.58 176.19 3.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.511 ' CE2' HG22 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.25 -152.67 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.913 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.405 ' C ' HG23 ' A' ' 32' ' ' VAL . 37.1 mt-10 -95.56 160.35 14.55 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 120.664 0.268 . . . . 1.0 110.687 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.713 HG13 ' O ' ' A' ' 8' ' ' LYS . 99.8 t -155.93 140.33 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.461 -0.336 . . . . 1.0 111.278 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 20.3 m -75.05 139.01 42.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.257 -0.429 . . . . 1.0 110.513 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 34' ' ' VAL . 29.0 m -128.29 120.92 21.28 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-O 120.491 0.186 . . . . 1.0 111.284 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HB3' HD23 ' A' ' 21' ' ' LEU . 36.6 Cg_endo -61.34 141.86 94.02 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.04 2.494 . . . . 1.0 112.325 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -48.73 -76.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 37' ' ' THR . 5.6 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.889 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.617 0.246 . . . . 1.0 111.224 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.767 HG21 ' HA ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -70.11 125.13 91.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.529 -0.305 . . . . 1.0 111.255 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.13 124.39 14.29 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.492 2.128 . . . . 1.0 112.119 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.465 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.88 -170.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.03 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.465 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 31.5 p-90 43.09 47.6 5.19 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.301 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.404 ' CD ' ' C ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -134.13 158.55 43.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.584 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.15 143.61 28.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.686 -0.769 . . . . 1.0 112.255 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 2.2 p -116.14 34.39 5.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.799 0.333 . . . . 1.0 111.31 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.56 128.23 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.329 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 59.5 18.92 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.279 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 mmm180 -149.66 66.2 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.256 0.55 . . . . 1.0 110.801 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.73 50.32 0.83 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.674 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 171.66 33.01 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.783 -0.723 . . . . 1.0 113.045 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.42 4.45 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.517 0.199 . . . . 1.0 110.628 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.767 ' HA ' HG21 ' A' ' 4' ' ' ILE . 86.6 m -70.34 148.52 48.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.788 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.446 ' N ' HG22 ' A' ' 4' ' ' ILE . 12.5 t -69.96 -93.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.366 -0.379 . . . . 1.0 110.897 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.41 -159.6 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.6 0.238 . . . . 1.0 110.747 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.29 41.38 2.46 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.587 -0.816 . . . . 1.0 112.751 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.573 HD23 ' CA ' ' A' ' 35' ' ' PRO . 1.2 mp -69.84 164.84 22.81 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 120.972 0.415 . . . . 1.0 111.389 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.544 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.7 OUTLIER -135.24 134.01 39.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.661 179.801 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.18 107.36 9.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.942 0.401 . . . . 1.0 110.82 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -93.45 126.12 38.42 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.292 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -74.17 136.98 42.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.467 . . . . 1.0 110.812 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -91.21 -162.97 0.97 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.584 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -70.03 -66.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 1.0 110.904 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.21 -52.37 2.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.79 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.88 171.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.962 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -68.6 -157.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.761 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 5.4 pt-20 -102.3 138.41 39.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 1.0 110.909 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.1 m -109.6 135.17 49.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.113 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 21' ' ' LEU . 14.2 t -59.72 135.85 57.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.093 -0.503 . . . . 1.0 111.414 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' GLU . 12.4 p -143.05 132.91 11.97 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-O 120.715 0.293 . . . . 1.0 111.363 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.573 ' CA ' HD23 ' A' ' 21' ' ' LEU . 32.6 Cg_endo -59.97 140.14 91.34 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.922 2.414 . . . . 1.0 112.576 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -66.37 -47.04 74.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.988 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.89 -0.595 . . . . 1.0 110.939 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.72 0.295 . . . . 1.0 111.061 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.415 ' CD1' ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -70.05 147.37 95.69 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 1.0 111.216 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 19.2 Cg_exo -64.11 130.7 28.05 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.622 2.215 . . . . 1.0 111.955 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.17 149.86 27.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 1.0 110.661 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.4 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 0.2 OUTLIER 63.11 36.42 12.22 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.836 -179.588 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -101.19 149.95 23.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.477 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.519 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -45.58 173.83 0.01 OUTLIER Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.3 -0.476 . . . . 1.0 113.531 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.427 ' O ' ' N ' ' A' ' 12' ' ' ASN . 19.3 t -104.45 -12.63 16.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.585 0.231 . . . . 1.0 111.424 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.97 82.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.993 0.425 . . . . 1.0 111.206 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 10' ' ' CYS . 6.0 t-20 177.46 75.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.473 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.412 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.0 OUTLIER 65.51 14.99 9.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.421 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 48.28 84.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.786 0.327 . . . . 1.0 111.334 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 109.37 53.31 0.6 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.58 -0.819 . . . . 1.0 112.517 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -111.43 20.73 16.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.562 0.22 . . . . 1.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' ' CD1' ' A' ' 4' ' ' ILE . 4.2 m -61.9 163.71 7.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.514 -0.312 . . . . 1.0 110.444 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.6 t -55.35 -94.71 0.0 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.77 -0.195 . . . . 1.0 110.798 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -66.64 -154.94 0.01 OUTLIER 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.1 -0.333 . . . . 1.0 110.1 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.49 33.27 1.59 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 1.0 113.001 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.814 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -69.71 151.47 45.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.93 0.365 . . . . 1.0 111.138 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.739 ' O ' HG12 ' A' ' 34' ' ' VAL . 1.5 pm0 -118.67 134.48 55.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.165 0.507 . . . . 1.0 110.291 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 14.6 p -79.1 126.9 31.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 33.0 m0 -108.78 135.99 49.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.011 -0.54 . . . . 1.0 111.203 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.5 tptm -90.1 134.65 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.458 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 174.93 5.67 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.084 0.468 . . . . 1.0 110.673 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -73.05 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.804 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -71.01 -66.98 0.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.548 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 p -69.28 152.14 45.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.213 -0.448 . . . . 1.0 110.714 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -147.11 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.731 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 8.5 mt-10 -89.92 169.44 11.23 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.841 0.353 . . . . 1.0 110.756 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.71 139.9 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 33.8 m -69.97 140.37 52.97 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.176 -0.466 . . . . 1.0 111.059 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 22' ' ' GLU . 7.2 p -143.2 138.24 15.48 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.674 -0.239 . . . . 1.0 111.095 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.814 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.3 Cg_endo -58.16 139.92 92.28 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.927 2.418 . . . . 1.0 112.747 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -51.18 -39.05 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 1.0 110.974 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.535 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 8.8 t . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 115.901 -0.591 . . . . 1.0 110.719 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 2.4 m . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.702 -0.111 . . . . 1.0 110.702 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 17' ' ' CYS . 11.0 tt -70.63 140.98 87.22 Favored Pre-proline 0 N--CA 1.455 -0.183 0 O-C-N 122.393 -0.192 . . . . 1.0 110.798 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 44.3 Cg_exo -54.19 113.18 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.085 1.857 . . . . 1.0 111.828 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.23 145.67 46.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.875 0.369 . . . . 1.0 110.806 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.8 m0 67.68 19.35 9.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.805 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.535 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -110.23 173.8 6.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.729 0.299 . . . . 1.0 110.806 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.3 150.94 28.68 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.836 -0.697 . . . . 1.0 112.63 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 12' ' ' ASN . 21.0 p -115.1 19.06 15.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.475 0.179 . . . . 1.0 111.311 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.47 82.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.85 0.357 . . . . 1.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 10' ' ' CYS . 4.6 t-20 177.59 81.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.568 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 73.84 5.47 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.742 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 46.23 83.63 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 120.888 0.375 . . . . 1.0 111.33 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.08 34.41 0.89 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.596 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.64 22.03 13.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.664 0.269 . . . . 1.0 110.858 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.478 ' HA ' HG21 ' A' ' 4' ' ' ILE . 11.6 m -58.41 165.59 2.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 1.0 110.674 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 39.5 t -70.24 -88.57 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.387 -0.369 . . . . 1.0 111.915 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -67.88 66.47 0.1 Allowed 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.879 0.371 . . . . 1.0 111.702 -178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 39.97 26.64 0.1 Allowed Glycine 0 C--O 1.225 -0.433 0 C-N-CA 121.228 -0.511 . . . . 1.0 113.817 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.27 151.16 46.6 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 120.983 0.42 . . . . 1.0 110.576 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -101.54 159.03 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 1.0 110.774 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.8 t -98.51 120.25 38.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.921 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.592 ' CD2' HG11 ' A' ' 34' ' ' VAL . 30.7 m0 -109.69 130.98 55.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.69 148.29 25.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.7 mmt-85 -114.03 129.51 56.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.643 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.13 -30.39 1.12 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.448 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 -82.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.63 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.6 p -70.14 -177.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.915 0.388 . . . . 1.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -153.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.662 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -113.32 136.83 52.33 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.806 0.336 . . . . 1.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.535 HG12 ' C ' ' A' ' 8' ' ' LYS . 9.7 m -126.04 163.99 26.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.302 -0.408 . . . . 1.0 111.374 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.3 m -69.23 161.07 29.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.738 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.592 HG11 ' CD2' ' A' ' 24' ' ' TRP . 8.9 p -170.33 138.16 1.36 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.382 -0.372 . . . . 1.0 110.938 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HD2' HG23 ' A' ' 34' ' ' VAL . 18.5 Cg_endo -53.85 136.04 64.8 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.004 2.469 . . . . 1.0 112.554 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -89.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.326 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.188 0 O-C-N 122.397 -0.19 . . . . 1.0 110.926 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.597 0.237 . . . . 1.0 110.776 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 17' ' ' CYS . 2.1 pp -70.1 141.76 89.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.229 . . . . 1.0 111.207 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -68.45 140.24 47.43 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.534 2.156 . . . . 1.0 111.95 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -71.72 162.95 28.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 24.3 m0 60.14 31.48 20.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.024 -0.535 . . . . 1.0 111.271 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -120.06 147.72 44.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.517 179.867 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.666 ' CA ' HG12 ' A' ' 32' ' ' VAL . . . -71.07 136.68 25.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.059 -0.591 . . . . 1.0 112.845 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -94.32 27.45 2.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.689 0.281 . . . . 1.0 111.009 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.1 p -67.6 70.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 1.0 110.987 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -177.22 -70.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.455 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 7.5 mmm180 -95.84 -9.49 31.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.342 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 53.63 92.41 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-O 121.087 0.47 . . . . 1.0 110.832 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.72 48.81 4.81 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.238 -179.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.464 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 0.0 OUTLIER -88.08 5.27 41.9 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.515 -0.342 . . . . 1.0 111.204 -179.113 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 21' ' ' LEU . 57.3 m -45.69 138.8 4.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.946 0.403 . . . . 1.0 111.779 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 t -70.4 -83.31 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.377 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' H ' HD11 ' A' ' 21' ' ' LEU . 14.2 mt-10 -63.79 -153.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.608 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 17.98 3.34 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.625 -0.797 . . . . 1.0 113.173 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.535 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.69 144.3 52.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.098 0.449 . . . . 1.0 110.525 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -116.07 160.01 20.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 1.0 110.928 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -91.61 109.71 21.02 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.85 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 36.9 m0 -115.64 149.54 38.16 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.29 -0.413 . . . . 1.0 111.291 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -70.7 128.4 35.94 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.006 -0.543 . . . . 1.0 110.93 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.529 ' HD2' HG21 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.88 -162.61 0.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.563 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -68.12 0.44 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.794 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 ttp-105 -103.89 -43.08 5.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.9 p -67.73 157.37 34.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.996 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -158.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.433 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 44.0 mt-10 -80.26 124.56 28.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 120.978 0.418 . . . . 1.0 110.887 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.666 HG12 ' CA ' ' A' ' 9' ' ' GLY . 34.7 m -117.3 160.99 16.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 1.0 111.048 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 5.0 m -69.51 142.41 53.69 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.284 -0.416 . . . . 1.0 111.131 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 22' ' ' GLU . 13.0 p -142.34 120.16 7.37 Favored Pre-proline 0 C--N 1.323 -0.557 0 C-N-CA 122.195 0.198 . . . . 1.0 111.073 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.6 Cg_endo -57.94 139.08 89.13 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.858 2.372 . . . . 1.0 112.475 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.94 -35.83 2.18 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.116 -0.493 . . . . 1.0 111.137 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.8 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.639 179.876 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.571 0.224 . . . . 1.0 111.077 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.03 142.33 90.29 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.188 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.17 124.88 15.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.512 2.141 . . . . 1.0 111.983 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -70.16 150.38 46.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 7' ' ' TRP . 2.0 m0 67.33 27.27 8.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 1.0 111.184 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.04 169.05 9.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.426 -0.352 . . . . 1.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 152.15 46.48 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.662 -0.78 . . . . 1.0 112.569 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.91 5.48 49.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.407 0.151 . . . . 1.0 111.407 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.5 p -70.93 65.41 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.085 0.469 . . . . 1.0 110.861 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -177.32 -54.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.871 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.427 ' HB3' ' CB ' ' A' ' 16' ' ' ASP . 1.0 OUTLIER -97.91 -38.28 9.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.814 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.26 84.88 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.049 -0.523 . . . . 1.0 111.448 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.13 -0.88 71.86 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.742 -0.742 . . . . 1.0 113.259 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.427 ' CB ' ' HB3' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -98.14 24.13 7.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.985 0.421 . . . . 1.0 110.65 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 172.63 0.03 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.035 -0.53 . . . . 1.0 111.052 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.6 t -64.62 -96.7 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.533 -0.303 . . . . 1.0 111.164 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 21' ' ' LEU . 3.2 mm-40 -65.78 -164.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 N-CA-C 110.202 -0.296 . . . . 1.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.28 39.53 0.86 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.646 -0.788 . . . . 1.0 112.779 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.4 OUTLIER -69.82 155.14 40.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 120.819 0.343 . . . . 1.0 111.157 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.524 ' OE1' HG23 ' A' ' 34' ' ' VAL . 0.2 OUTLIER -127.98 135.81 50.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.598 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.5 m -74.78 127.59 33.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.009 -0.541 . . . . 1.0 111.134 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.468 ' CD2' HG21 ' A' ' 34' ' ' VAL . 18.9 m0 -119.28 133.95 55.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.877 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -83.14 148.07 27.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.768 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.835 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -76.16 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.133 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.44 -59.45 2.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.464 . . . . 1.0 110.923 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.58 162.25 3.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.736 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -82.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.792 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -159.53 144.38 15.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 1.0 111.073 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.9 m -125.94 143.23 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.287 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 148.92 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.249 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.524 HG23 ' OE1' ' A' ' 22' ' ' GLU . 2.2 m -147.46 132.87 9.21 Favored Pre-proline 0 C--N 1.323 -0.562 0 C-N-CA 122.401 0.281 . . . . 1.0 111.245 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -57.27 136.37 75.9 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.875 2.383 . . . . 1.0 112.685 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -68.96 -45.7 70.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.02 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 37' ' ' THR . 10.1 t . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.446 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.522 -0.118 0 CA-C-O 120.768 0.318 . . . . 1.0 111.307 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.576 HG23 ' O ' ' A' ' 4' ' ' ILE . 8.0 tp -70.18 116.38 43.99 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 111.291 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.48 117.59 4.33 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.391 2.061 . . . . 1.0 111.885 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.62 169.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.18 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 25.4 m95 61.82 38.15 14.97 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.075 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.25 164.34 30.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.78 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.73 136.22 47.71 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.757 -0.735 . . . . 1.0 112.539 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.4 p -117.36 21.83 12.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.654 0.264 . . . . 1.0 111.275 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -59.05 87.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.901 0.381 . . . . 1.0 111.101 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -176.84 78.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 70.75 5.18 5.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.83 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 44.24 83.04 0.03 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.015 0.436 . . . . 1.0 111.412 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.25 10.29 1.96 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.67 -0.776 . . . . 1.0 113.143 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.89 11.84 23.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.226 0.513 . . . . 1.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' HG21 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -57.76 179.63 0.06 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 1.0 110.891 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.8 t -68.99 -95.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.692 -0.231 . . . . 1.0 111.036 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 -155.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.212 -0.292 . . . . 1.0 110.212 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.76 34.71 2.31 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.725 -0.75 . . . . 1.0 112.784 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.759 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.48 152.77 44.46 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 120.781 0.324 . . . . 1.0 111.023 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.3 pt-20 -116.85 158.39 24.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.917 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.0 m -86.69 113.85 22.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.902 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.797 ' CD2' HG11 ' A' ' 34' ' ' VAL . 18.8 m0 -108.4 136.4 48.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.822 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -88.18 150.85 23.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.037 0.446 . . . . 1.0 110.948 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -110.39 122.58 48.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.679 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -46.31 -40.5 11.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.275 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -92.51 -75.94 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -176.11 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.153 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -149.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 1.0 110.728 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.33 176.1 7.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.764 0.316 . . . . 1.0 110.677 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -170.11 144.81 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.451 -0.341 . . . . 1.0 111.388 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 153.63 40.03 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.96 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.797 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.1 p -146.53 137.23 12.48 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 116.727 -0.215 . . . . 1.0 111.547 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.759 ' HA ' HD23 ' A' ' 21' ' ' LEU . 36.8 Cg_endo -61.36 145.79 97.91 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.953 2.435 . . . . 1.0 112.464 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -131.54 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.331 -0.395 . . . . 1.0 110.48 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 68.5 m . . . . . 0 C--N 1.332 -0.187 0 CA-C-O 120.614 0.245 . . . . 1.0 110.878 179.894 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.619 0.247 . . . . 1.0 111.178 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.561 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.6 pp -58.15 161.23 7.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.515 -0.311 . . . . 1.0 111.375 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -81.97 112.16 2.29 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.019 2.479 . . . . 1.0 111.774 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 pttt -58.3 155.48 11.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.918 0.389 . . . . 1.0 111.163 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.4 m95 60.38 43.38 13.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.349 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' C ' HG12 ' A' ' 32' ' ' VAL . 4.6 mmtp -142.6 170.16 16.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.94 162.85 6.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.77 -0.729 . . . . 1.0 112.607 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.407 ' O ' ' N ' ' A' ' 12' ' ' ASN . 3.2 m -127.03 19.23 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.426 0.155 . . . . 1.0 111.302 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 t -57.42 85.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.78 0.324 . . . . 1.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 10' ' ' CYS . 30.4 t-20 179.76 80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 1.0 110.526 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 68.28 13.59 9.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.264 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.94 37.1 4.55 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.406 -0.361 . . . . 1.0 111.455 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 174.15 37.23 0.04 OUTLIER Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.999 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.8 15.04 29.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.531 0.205 . . . . 1.0 110.962 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.12 174.86 4.99 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.587 -0.278 . . . . 1.0 110.655 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.402 ' HB3' HD11 ' A' ' 21' ' ' LEU . 51.3 t -70.03 -105.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.753 -0.203 . . . . 1.0 111.045 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.43 ' N ' HD11 ' A' ' 21' ' ' LEU . 6.4 mm-40 -60.23 -161.47 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.163 -0.31 . . . . 1.0 110.163 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.48 39.41 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.413 -0.899 . . . . 1.0 112.87 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.661 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -70.01 147.95 49.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.823 0.344 . . . . 1.0 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.3 OUTLIER -117.03 153.56 32.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.003 0.43 . . . . 1.0 110.647 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.19 114.37 26.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.282 -0.417 . . . . 1.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -103.47 129.8 50.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.075 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -84.64 134.66 34.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.704 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -163.55 0.85 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.353 . . . . 1.0 110.641 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -79.7 0.06 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.636 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.47 -39.25 10.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.593 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.97 167.99 4.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.846 -0.616 . . . . 1.0 111.024 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -156.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -107.35 155.08 20.39 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.828 0.346 . . . . 1.0 110.721 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.426 HG12 ' C ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -141.18 138.57 33.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.315 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.65 155.26 16.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.609 HG12 ' O ' ' A' ' 22' ' ' GLU . 5.9 p -155.28 116.72 2.36 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.024 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.661 ' HB3' HD23 ' A' ' 21' ' ' LEU . 30.7 Cg_endo -60.0 137.76 77.89 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.764 2.309 . . . . 1.0 112.596 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.2 -67.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.907 -0.588 . . . . 1.0 111.436 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.543 -0.298 . . . . 1.0 111.075 179.994 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 120.603 0.24 . . . . 1.0 111.433 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.441 HD12 ' O ' ' A' ' 5' ' ' PRO . 2.5 pp -70.1 144.7 93.0 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.402 -0.363 . . . . 1.0 111.287 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.441 ' O ' HD12 ' A' ' 4' ' ' ILE . 41.9 Cg_exo -55.11 140.71 80.65 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.382 2.055 . . . . 1.0 112.052 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 18.0 pttt -96.02 30.81 2.3 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.996 0.427 . . . . 1.0 111.198 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 8.6 m95 -148.21 29.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.754 -0.657 . . . . 1.0 110.737 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.753 ' O ' HG23 ' A' ' 32' ' ' VAL . 27.9 mmtm -118.68 161.69 19.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.385 . . . . 1.0 110.999 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 31' ' ' GLU . . . -54.71 -179.16 0.18 Allowed Glycine 0 C--N 1.329 0.163 0 C-N-CA 121.053 -0.594 . . . . 1.0 112.434 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 31' ' ' GLU . 1.6 t -131.86 11.03 4.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 111.607 0.225 . . . . 1.0 111.607 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 11' ' ' VAL . 13.0 p -77.32 55.07 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.949 0.404 . . . . 1.0 111.092 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 51.5 t-20 172.96 -36.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.111 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mmt-85 -81.46 -52.18 7.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.779 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 51.43 67.05 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.121 0.486 . . . . 1.0 110.937 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.55 26.08 66.3 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.813 -0.708 . . . . 1.0 112.271 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.77 23.43 11.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.619 0.247 . . . . 1.0 110.919 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 4' ' ' ILE . 3.5 m -58.65 167.56 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 1.0 110.388 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -60.31 -85.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.531 -179.775 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.432 ' N ' ' SG ' ' A' ' 18' ' ' CYS . 22.9 mt-10 -70.34 -161.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.06 37.76 1.32 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.373 -0.918 . . . . 1.0 112.342 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.0 154.2 42.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.069 0.461 . . . . 1.0 110.95 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.575 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -109.72 149.86 29.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.315 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.25 98.74 9.97 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 1.0 110.537 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.656 ' CD2' HG11 ' A' ' 34' ' ' VAL . 42.6 m0 -76.74 133.55 39.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 1.0 111.131 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -84.56 165.82 17.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.777 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 148.79 35.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.696 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -56.12 -54.57 43.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.995 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 mtp85 -70.32 -80.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 1.0 110.624 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 p -70.12 163.04 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.765 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -80.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.419 ' O ' ' HA2' ' A' ' 9' ' ' GLY . 18.2 mt-10 -154.82 -167.97 2.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.743 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.753 HG23 ' O ' ' A' ' 8' ' ' LYS . 7.3 p -170.28 142.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 1.0 111.027 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.8 m -67.01 159.99 27.47 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.502 -0.317 . . . . 1.0 110.621 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.656 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.7 p -173.18 137.55 0.77 Allowed Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 111.613 0.227 . . . . 1.0 111.613 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.815 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.2 Cg_endo -59.01 140.86 97.23 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.955 2.437 . . . . 1.0 112.418 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -60.34 -78.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 80.0 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.347 -0.388 . . . . 1.0 110.792 179.974 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.71 0.29 . . . . 1.0 110.756 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.847 HD11 ' HG3' ' A' ' 8' ' ' LYS . 0.5 OUTLIER -70.14 117.6 55.85 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.081 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.8 171.78 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.633 2.222 . . . . 1.0 112.852 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 35' ' ' PRO . 34.0 pttt -87.39 50.45 2.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.927 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.454 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.0 m95 -147.99 29.32 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.433 -0.349 . . . . 1.0 111.1 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.847 ' HG3' HD11 ' A' ' 4' ' ' ILE . 9.6 tmtm? -116.69 137.98 51.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.27 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.412 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -50.18 144.87 9.93 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.997 -0.62 . . . . 1.0 112.671 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 p -109.99 7.34 23.67 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.755 0.28 . . . . 1.0 111.755 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.592 HG22 ' OE2' ' A' ' 31' ' ' GLU . 34.8 t -61.95 138.22 22.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.538 0.209 . . . . 1.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.1 t-20 68.88 84.53 0.15 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.207 0.527 . . . . 1.0 109.629 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 1.2 mmm180 76.39 82.32 0.09 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.075 -0.966 . . . . 1.0 109.845 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -67.48 49.74 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.986 -1.006 . . . . 1.0 111.897 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -160.66 22.26 0.24 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 121.169 -0.539 . . . . 1.0 112.356 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -6.86 59.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.616 0.246 . . . . 1.0 110.982 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.836 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.9 t -69.73 -159.81 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.788 -0.449 . . . . 1.0 109.788 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.469 ' N ' ' CG2' ' A' ' 4' ' ' ILE . 42.3 t -70.31 -105.29 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.15 0.426 . . . . 1.0 112.15 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.637 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -70.43 -160.46 0.04 OUTLIER 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.566 0.222 . . . . 1.0 110.851 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.18 47.67 2.66 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.313 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.836 HD13 ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -69.4 144.15 53.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.915 0.388 . . . . 1.0 110.763 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.5 165.68 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.232 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.27 107.2 17.7 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.851 -0.613 . . . . 1.0 110.571 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -102.22 126.97 49.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.83 145.05 29.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.619 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -107.02 123.08 47.68 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -46.31 -29.88 1.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.025 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.57 -70.99 0.73 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.74 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.8 p -70.15 179.59 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.954 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.96 -155.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.967 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' HG22 ' A' ' 11' ' ' VAL . 7.9 mt-10 -99.24 -178.47 3.93 Favored 'General case' 0 N--CA 1.458 -0.071 0 CA-C-N 116.614 -0.267 . . . . 1.0 110.535 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.481 HG22 ' N ' ' A' ' 33' ' ' CYS . 4.8 p -170.21 157.39 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.811 0.339 . . . . 1.0 111.82 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.481 ' N ' HG22 ' A' ' 32' ' ' VAL . 4.5 p -99.54 117.63 34.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.789 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 34' ' ' VAL . 13.5 p -109.32 117.27 53.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.68 -0.236 . . . . 1.0 111.61 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.777 ' HB3' HD23 ' A' ' 21' ' ' LEU . 29.1 Cg_endo -59.79 132.08 43.32 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.843 2.362 . . . . 1.0 113.14 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -70.71 -47.18 61.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.598 -0.728 . . . . 1.0 110.654 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.9 t . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.959 -0.564 . . . . 1.0 110.998 -179.984 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.66 0.267 . . . . 1.0 111.061 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 5' ' ' PRO . 1.8 pp -69.96 140.55 88.72 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.265 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.424 ' O ' HD12 ' A' ' 4' ' ' ILE . 23.7 Cg_exo -62.2 149.96 88.62 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.391 2.06 . . . . 1.0 112.03 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.489 ' HB3' ' CD1' ' A' ' 7' ' ' TRP . 17.4 mtmm -60.53 165.69 3.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 1.0 110.955 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 46.91 69.98 0.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.067 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' GLY . 4.4 tmtm? -129.46 132.15 46.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.839 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.414 ' N ' ' HD3' ' A' ' 8' ' ' LYS . . . -48.94 139.74 12.58 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 121.235 -0.507 . . . . 1.0 112.811 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.8 p -106.04 -3.22 21.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.511 0.196 . . . . 1.0 111.396 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.6 t -83.25 64.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.827 0.346 . . . . 1.0 111.373 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.41 ' N ' ' OD1' ' A' ' 12' ' ' ASN . 1.4 p30 -153.89 -86.87 0.06 Allowed 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.855 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 -88.15 -11.89 45.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.597 0.237 . . . . 1.0 111.32 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 53.81 79.22 0.13 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.0 0.429 . . . . 1.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.67 6.82 6.45 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.818 -0.705 . . . . 1.0 112.743 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -69.89 -13.98 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.991 0.395 . . . . 1.0 111.034 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.45 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 84.8 m -59.23 142.49 51.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.589 -0.278 . . . . 1.0 110.501 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.427 ' HB3' HD11 ' A' ' 21' ' ' LEU . 46.4 t -56.98 -103.36 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.428 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.456 ' N ' HD11 ' A' ' 21' ' ' LEU . 17.0 mm-40 -63.97 -157.19 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.079 -0.341 . . . . 1.0 110.079 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.82 42.4 2.04 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.521 -0.847 . . . . 1.0 112.935 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.684 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -71.68 148.67 46.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.8 0.333 . . . . 1.0 110.894 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -123.84 148.85 46.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.186 0.517 . . . . 1.0 110.856 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 6.8 p -90.79 119.07 30.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.089 -0.505 . . . . 1.0 111.47 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' OE1' ' A' ' 22' ' ' GLU . 35.8 m0 -101.09 125.67 47.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.716 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -73.78 136.51 43.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 1.0 110.475 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.99 -168.45 1.46 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.331 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -46.92 87.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.622 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.71 -42.3 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.636 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.3 t -59.07 173.03 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.011 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.726 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.5 OUTLIER -61.95 -167.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.366 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.26 146.24 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.457 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' HA ' ' A' ' 7' ' ' TRP . 3.9 m -128.36 137.64 56.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.953 0.406 . . . . 1.0 111.377 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -61.77 146.49 49.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.145 -0.479 . . . . 1.0 111.521 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 22' ' ' GLU . 8.8 p -147.12 127.17 6.73 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.896 -0.593 . . . . 1.0 110.831 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.684 ' CA ' HD23 ' A' ' 21' ' ' LEU . 20.0 Cg_endo -56.91 131.12 43.58 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.877 2.385 . . . . 1.0 112.929 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 ptmm? -70.14 -100.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.728 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.5 m . . . . . 0 C--N 1.333 -0.144 0 CA-C-O 120.485 0.183 . . . . 1.0 110.667 179.646 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.655 0.264 . . . . 1.0 111.04 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.489 HD12 ' C ' ' A' ' 4' ' ' ILE . 1.4 pp -70.13 157.82 88.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.264 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.46 ' C ' HD12 ' A' ' 4' ' ' ILE . 5.1 Cg_exo -75.12 120.01 5.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.781 2.321 . . . . 1.0 111.928 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' C ' ' CG ' ' A' ' 7' ' ' TRP . 12.1 mttt -51.11 148.02 4.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 1.0 111.363 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.44 ' CG ' ' C ' ' A' ' 6' ' ' LYS . 0.7 OUTLIER 44.04 68.94 0.46 Allowed 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 115.859 -0.61 . . . . 1.0 111.98 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 5' ' ' PRO . 36.2 mmtt -148.28 173.81 12.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 1.0 110.831 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -48.31 152.46 2.34 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 121.034 -0.603 . . . . 1.0 112.771 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 31' ' ' GLU . 62.6 m -96.54 0.51 50.21 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.59 0.219 . . . . 1.0 111.59 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.3 p -49.79 89.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 120.936 0.398 . . . . 1.0 111.182 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.6 t-20 173.61 84.49 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 1.0 109.997 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.11 27.71 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 42.71 32.79 0.41 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.948 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.09 37.58 0.04 OUTLIER Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.131 -1.033 . . . . 1.0 113.195 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -107.41 14.75 25.62 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.679 0.276 . . . . 1.0 110.611 179.47 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' HD13 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -57.1 177.23 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.655 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.464 ' HB3' HD11 ' A' ' 21' ' ' LEU . 50.3 t -70.17 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.029 -0.268 . . . . 1.0 111.524 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.66 -152.25 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.614 0.245 . . . . 1.0 110.745 179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.96 37.38 2.52 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.707 -0.759 . . . . 1.0 112.788 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.1 OUTLIER -69.86 145.03 52.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.009 0.433 . . . . 1.0 110.726 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.887 ' HG2' HG23 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -91.7 159.44 15.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.702 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.58 114.46 27.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.864 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.5 m0 -99.28 101.17 12.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.87 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 140.27 36.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 1.0 110.762 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -105.27 117.33 33.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.484 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -45.93 -31.5 2.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.108 -0.496 . . . . 1.0 111.221 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mmt-85 -85.88 -86.62 0.14 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.631 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.0 t -70.39 -164.16 0.08 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.833 0.349 . . . . 1.0 110.856 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -154.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.484 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 10' ' ' CYS . 23.5 mt-10 -109.59 175.64 5.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.666 -0.243 . . . . 1.0 110.368 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.2 t -152.79 139.38 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 1.0 111.706 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 151.46 21.48 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.958 -0.565 . . . . 1.0 110.409 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.887 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 m -145.25 122.52 6.25 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 111.642 0.238 . . . . 1.0 111.642 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 21' ' ' LEU . 38.6 Cg_endo -61.96 142.09 91.7 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.24 2.627 . . . . 1.0 112.54 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.221 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.602 -0.272 . . . . 1.0 111.254 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.522 -0.102 0 CA-C-O 121.01 0.433 . . . . 1.0 111.159 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.51 HD12 ' H ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -69.71 172.07 6.11 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.446 ' CD ' ' HB ' ' A' ' 4' ' ' ILE . 13.3 Cg_exo -68.77 116.16 4.3 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.672 2.248 . . . . 1.0 111.851 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -88.99 39.81 0.95 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.268 -179.68 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 43.1 m95 -150.22 22.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.0 110.666 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 mmtm -115.6 158.5 22.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.028 0.442 . . . . 1.0 111.07 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.0 173.67 0.59 Allowed Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.792 -0.64 . . . . 1.0 113.092 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 t -106.55 -2.76 21.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.585 0.231 . . . . 1.0 111.514 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.562 HG13 ' O ' ' A' ' 11' ' ' VAL . 12.7 p -76.88 60.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.944 0.402 . . . . 1.0 111.254 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -178.64 -56.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 1.0 110.728 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -48.19 18.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.17 32.05 10.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.938 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 111.56 4.78 26.52 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.902 -0.666 . . . . 1.0 112.539 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -0.83 50.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.828 0.314 . . . . 1.0 111.312 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.986 ' HB3' HD13 ' A' ' 21' ' ' LEU . 64.0 m -53.35 170.57 0.09 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.682 -0.235 . . . . 1.0 110.761 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.917 ' SG ' HD11 ' A' ' 21' ' ' LEU . 21.8 p -63.43 -123.94 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 121.231 -0.188 . . . . 1.0 111.451 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 21' ' ' LEU . 1.1 mt-10 -46.77 91.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 112.866 0.691 . . . . 1.0 112.866 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' GLU . . . 18.15 45.61 0.01 OUTLIER Glycine 0 C--N 1.337 0.608 0 CA-C-N 114.962 -1.017 . . . . 1.0 115.452 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' A' ' 17' ' ' CYS . 3.0 mp -68.83 161.05 29.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 117.207 0.503 . . . . 1.0 110.894 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -132.89 133.74 43.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.428 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 8.1 p -84.51 115.56 22.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.08 0.467 . . . . 1.0 111.127 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.456 ' CD2' HG21 ' A' ' 34' ' ' VAL . 52.0 m0 -90.19 134.21 34.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.591 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 142.86 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.955 0.407 . . . . 1.0 110.956 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -115.66 135.43 54.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 1.0 110.464 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.98 -50.43 19.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.672 -0.694 . . . . 1.0 111.433 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -89.04 -71.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.19 173.99 6.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.751 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -146.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.516 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -107.63 131.47 54.35 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 110.447 -0.205 . . . . 1.0 110.447 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 23.4 m -115.41 138.57 45.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.632 0.254 . . . . 1.0 111.625 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -66.01 147.12 53.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.545 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.456 HG21 ' CD2' ' A' ' 24' ' ' TRP . 2.4 m -149.92 125.13 4.84 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.704 ' N ' HD23 ' A' ' 21' ' ' LEU . 17.8 Cg_endo -56.61 132.79 53.9 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.768 2.312 . . . . 1.0 112.943 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -70.26 -111.31 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.761 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 37' ' ' THR . 10.0 t . . . . . 0 CA--C 1.531 0.232 0 O-C-N 122.297 -0.252 . . . . 1.0 111.028 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 120.541 0.21 . . . . 1.0 111.198 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.4 pp -63.73 140.38 97.8 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.635 -0.257 . . . . 1.0 111.186 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.0 148.15 93.65 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.528 2.152 . . . . 1.0 112.303 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -95.19 38.51 1.13 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.885 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -156.86 27.99 0.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.701 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.697 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -120.14 166.54 13.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.033 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.49 35.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.725 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.96 26.73 8.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.709 0.29 . . . . 1.0 110.979 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE2' ' A' ' 30' ' ' PHE . 22.0 t -100.6 71.88 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.142 0.496 . . . . 1.0 111.091 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -176.83 -62.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 1.0 110.613 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.68 -46.3 22.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 55.7 87.2 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.05 -12.8 9.77 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.386 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -11.67 61.07 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.642 0.258 . . . . 1.0 111.185 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.3 m -48.44 144.83 3.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.708 -0.224 . . . . 1.0 110.55 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.3 t -59.61 -102.6 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.218 -0.193 . . . . 1.0 111.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.3 -157.59 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 N-CA-C 110.291 -0.263 . . . . 1.0 110.291 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.17 43.12 2.44 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.508 -0.854 . . . . 1.0 112.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.456 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.71 148.72 48.87 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 120.972 0.415 . . . . 1.0 111.216 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -111.76 151.05 29.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 1.0 111.29 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.2 m -78.17 120.21 22.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.673 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.419 ' CD2' HG11 ' A' ' 34' ' ' VAL . 6.9 m0 -119.02 139.37 51.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.863 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -81.67 147.39 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.963 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -120.02 138.81 53.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.104 0.478 . . . . 1.0 110.543 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.12 -57.93 7.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 1.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -71.91 0.42 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.724 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.99 170.3 8.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.845 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.711 ' CE2' HG21 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.24 -145.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.112 -0.495 . . . . 1.0 110.935 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -97.21 126.63 42.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.781 0.324 . . . . 1.0 110.769 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.697 HG12 ' C ' ' A' ' 8' ' ' LYS . 27.6 m -124.15 152.21 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 116.343 -0.389 . . . . 1.0 111.563 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.19 149.05 37.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.215 -0.448 . . . . 1.0 111.173 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.451 HG23 ' HD2' ' A' ' 35' ' ' PRO . 10.8 p -148.58 137.34 11.86 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.527 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.451 ' HD2' HG23 ' A' ' 34' ' ' VAL . 20.9 Cg_endo -56.58 138.27 84.04 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.954 2.436 . . . . 1.0 112.484 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -102.76 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.135 -0.484 . . . . 1.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.494 0.188 . . . . 1.0 111.126 -179.898 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 18' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.674 0.273 . . . . 1.0 110.745 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.471 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.1 pt -60.0 157.48 30.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.503 -0.317 . . . . 1.0 110.648 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.441 ' HB2' ' CE ' ' A' ' 8' ' ' LYS . 52.5 Cg_exo -53.46 96.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 122.385 2.057 . . . . 1.0 112.002 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.76 151.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.29 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.428 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 38.6 m0 63.4 49.88 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.231 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 32' ' ' VAL . 1.5 tptp -117.04 152.76 33.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 1.0 110.809 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.43 158.23 23.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.681 -0.771 . . . . 1.0 112.22 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -3.49 45.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.528 0.204 . . . . 1.0 111.325 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.3 p -69.02 69.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.908 0.385 . . . . 1.0 110.843 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.424 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.6 t-20 -177.97 80.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.054 -0.521 . . . . 1.0 110.506 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.8 OUTLIER 68.22 12.12 8.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.572 . . . . 1.0 111.351 -179.784 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 42.34 79.43 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.859 0.361 . . . . 1.0 111.511 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.81 46.01 0.62 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -96.45 23.79 6.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.906 0.384 . . . . 1.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.724 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.2 m -70.11 144.56 52.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.403 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.734 ' SG ' HD11 ' A' ' 21' ' ' LEU . 1.6 p -55.71 -105.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.568 -0.287 . . . . 1.0 111.748 -179.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -57.28 -155.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.644 0.259 . . . . 1.0 110.812 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.411 ' H ' ' HB2' ' A' ' 19' ' ' GLU . . . -71.49 32.02 0.58 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.766 -0.731 . . . . 1.0 114.429 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.734 HD11 ' SG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -73.13 140.06 46.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.744 0.772 . . . . 1.0 110.186 179.143 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -108.66 162.89 13.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.906 0.384 . . . . 1.0 111.158 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.85 100.38 13.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.729 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 25.7 m0 -100.35 144.64 29.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.073 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.56 133.26 39.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.721 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.97 -172.25 2.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.012 0.434 . . . . 1.0 110.759 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -70.27 -71.52 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.811 -0.632 . . . . 1.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -70.88 -76.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.038 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -58.85 147.49 33.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 1.0 110.835 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.0 110.497 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.64 137.72 51.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.775 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 8' ' ' LYS . 11.2 p -132.8 145.27 34.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.373 -0.376 . . . . 1.0 111.268 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 53.4 m -61.8 137.27 58.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.961 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.52 126.93 7.62 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.801 -0.182 . . . . 1.0 111.348 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -59.53 141.85 97.96 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.92 2.413 . . . . 1.0 112.486 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -49.79 -62.68 1.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.041 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.5 m . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.686 179.857 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.233 0 CA-C-O 120.656 0.265 . . . . 1.0 110.748 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.6 pp -51.9 141.29 28.27 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 1.0 111.66 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -80.08 158.79 23.74 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.787 2.325 . . . . 1.0 111.862 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -62.04 161.5 10.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.952 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.443 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 42.6 m0 62.78 48.06 4.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.921 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -130.03 142.32 50.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.31 175.81 2.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 1.0 112.641 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.412 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 1.9 t -104.95 1.88 29.21 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.576 0.214 . . . . 1.0 111.576 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.0 p -67.39 68.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 CA-C-O 121.124 0.488 . . . . 1.0 111.11 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -169.95 76.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.591 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 75.61 7.17 3.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.245 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 49.04 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.317 . . . . 1.0 111.35 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.4 38.8 1.07 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.962 -0.637 . . . . 1.0 112.495 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.91 20.42 13.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.649 0.262 . . . . 1.0 111.252 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.477 ' HA ' HD11 ' A' ' 4' ' ' ILE . 58.4 m -55.39 147.3 17.54 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.561 0.219 . . . . 1.0 110.562 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 42.4 t -61.84 -96.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.617 -0.265 . . . . 1.0 110.939 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.504 ' H ' HD11 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -62.56 -154.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.028 -0.36 . . . . 1.0 110.028 179.392 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.47 33.43 1.59 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.594 -0.812 . . . . 1.0 112.896 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.504 HD11 ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.62 157.08 28.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.909 0.385 . . . . 1.0 111.042 -179.745 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 34' ' ' VAL . 1.9 pt-20 -132.2 126.24 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.347 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 13.2 p -69.48 109.69 4.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.084 0.469 . . . . 1.0 111.115 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.4 ' CE3' HG21 ' A' ' 34' ' ' VAL . 51.2 m0 -97.4 143.74 27.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.861 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -67.5 146.89 53.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 1.0 110.895 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -128.01 -177.75 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.575 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -78.51 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.898 -0.592 . . . . 1.0 111.229 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.39 -73.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.331 -0.395 . . . . 1.0 111.12 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -65.59 168.21 7.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.45 -0.341 . . . . 1.0 110.95 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -81.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.42 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.412 ' HG3' ' HB2' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -153.39 136.38 15.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.31 -0.404 . . . . 1.0 110.64 179.907 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.2 m -121.13 141.63 40.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.36 -0.382 . . . . 1.0 111.487 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 79.6 m -58.79 133.35 55.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.02 -0.537 . . . . 1.0 111.323 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 22' ' ' GLU . 5.2 m -137.66 133.32 17.83 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.028 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.2 136.94 75.55 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.971 2.448 . . . . 1.0 112.403 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -51.21 -47.05 62.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.8 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.87 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.737 0.303 . . . . 1.0 111.18 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 2.3 pp -70.3 143.34 90.69 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.4 -0.364 . . . . 1.0 111.258 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 3.0 Cg_exo -73.65 140.36 29.4 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.553 2.169 . . . . 1.0 111.661 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 1.0 OUTLIER -55.52 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.984 0.421 . . . . 1.0 111.103 -179.848 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.482 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 48.0 p-90 41.14 32.34 0.18 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.748 -0.66 . . . . 1.0 111.344 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.83 143.93 31.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 1.0 111.066 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.58 152.49 51.53 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.574 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.9 m -86.13 -4.74 59.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.641 0.258 . . . . 1.0 111.417 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.415 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.5 t -68.51 72.5 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.957 0.408 . . . . 1.0 110.953 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -176.23 78.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.974 -0.557 . . . . 1.0 110.826 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.46 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 0.9 OUTLIER 74.63 4.33 4.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.642 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 47.13 83.93 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.761 0.315 . . . . 1.0 111.247 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.49 38.21 0.6 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.662 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.443 ' O ' HG21 ' A' ' 4' ' ' ILE . 0.3 OUTLIER -98.97 10.11 42.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.507 0.194 . . . . 1.0 111.295 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HB3' HD13 ' A' ' 21' ' ' LEU . 10.0 m -65.9 152.24 44.93 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.656 -0.247 . . . . 1.0 110.534 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.441 ' HB3' HD11 ' A' ' 21' ' ' LEU . 35.4 t -59.22 -100.64 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.769 -0.196 . . . . 1.0 111.048 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -70.13 -161.65 0.05 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.467 0.175 . . . . 1.0 110.558 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.45 47.88 2.12 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.609 -0.805 . . . . 1.0 112.192 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.08 151.1 45.88 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.968 0.413 . . . . 1.0 111.069 -179.675 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.94 142.9 26.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.988 -0.551 . . . . 1.0 111.222 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 23.0 t -89.24 103.32 15.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.986 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -81.22 90.09 6.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.75 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.96 133.97 33.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.264 0.554 . . . . 1.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -99.12 117.9 34.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.947 -0.57 . . . . 1.0 110.649 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 -43.27 -31.91 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.369 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -59.14 1.99 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.353 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.06 -179.81 2.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.012 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.415 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -70.08 -166.74 0.13 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.009 179.799 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -113.14 160.25 18.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.589 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -160.05 131.42 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.582 -0.281 . . . . 1.0 111.207 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.48 149.33 28.79 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.397 -0.365 . . . . 1.0 111.127 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 35' ' ' PRO . 12.7 p -145.35 136.48 12.52 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 1.0 111.287 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.765 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.8 Cg_endo -58.87 138.63 86.78 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.201 2.601 . . . . 1.0 112.625 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -69.72 -40.01 76.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.159 -0.473 . . . . 1.0 111.076 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.45 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.4 m . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.145 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 4.1 m . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.404 0.145 . . . . 1.0 111.018 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.463 HD11 ' SG ' ' A' ' 17' ' ' CYS . 2.2 pp -70.52 158.13 88.47 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.273 . . . . 1.0 111.263 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -59.63 98.37 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.434 2.09 . . . . 1.0 111.646 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -46.33 134.49 8.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.003 0.43 . . . . 1.0 111.576 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 28.3 m0 64.29 75.68 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.173 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -156.5 174.55 15.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.61 179.55 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -55.31 132.13 49.04 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.847 -0.692 . . . . 1.0 112.791 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -98.61 23.64 8.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.623 0.249 . . . . 1.0 111.217 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' CD2' ' A' ' 30' ' ' PHE . 20.1 t -75.62 77.75 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.939 0.4 . . . . 1.0 110.972 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -176.9 78.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 73.6 5.32 4.9 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.211 -0.449 . . . . 1.0 111.691 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.98 34.52 2.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.629 0.252 . . . . 1.0 111.383 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 179.46 35.79 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.411 -0.9 . . . . 1.0 112.816 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.28 14.68 31.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 1.0 110.938 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.463 ' SG ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -70.08 167.62 17.28 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.464 -0.335 . . . . 1.0 111.036 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 42.0 t -67.47 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.236 -0.438 . . . . 1.0 111.45 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -155.12 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.56 0.219 . . . . 1.0 110.639 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.25 34.6 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.618 -0.801 . . . . 1.0 113.282 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.751 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.67 150.24 47.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.9 0.35 . . . . 1.0 110.671 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.445 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.0 pt-20 -126.3 144.27 50.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.066 0.46 . . . . 1.0 111.112 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.4 m -73.88 124.47 26.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.839 -0.619 . . . . 1.0 110.782 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.562 ' CD2' HG11 ' A' ' 34' ' ' VAL . 22.3 m0 -113.73 122.98 48.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.899 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -57.47 150.94 17.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.001 0.429 . . . . 1.0 110.92 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.07 141.53 48.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.547 . . . . 1.0 110.592 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -41.5 66.64 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 1.0 111.134 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.49 -81.97 0.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.785 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.83 -179.84 1.97 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.758 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -69.96 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.52 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 mp0 -140.82 140.25 34.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 1.0 110.753 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -122.98 129.12 75.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 1.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 149.49 40.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.221 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.5 p -147.45 123.59 5.46 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.441 -0.345 . . . . 1.0 111.364 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.751 ' CA ' HD23 ' A' ' 21' ' ' LEU . 29.0 Cg_endo -59.23 138.59 85.74 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.61 2.207 . . . . 1.0 112.651 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -30.2 70.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.892 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.2 m . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.97 -179.828 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.724 0.297 . . . . 1.0 110.861 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.544 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.5 pp -70.18 158.6 87.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.848 0.356 . . . . 1.0 110.946 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -61.12 93.76 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.476 2.117 . . . . 1.0 112.23 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -61.72 146.68 48.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.787 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 35.3 m95 61.69 38.48 15.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.075 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.765 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.8 mmtm -131.07 -176.14 3.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.879 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.49 -170.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.655 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.41 ' O ' ' ND1' ' A' ' 14' ' ' HIS . 1.6 m -115.06 -4.74 12.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 111.606 0.224 . . . . 1.0 111.606 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 18.9 t -68.2 63.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.848 0.356 . . . . 1.0 111.389 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 56.9 t-20 174.34 83.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.329 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 mmm180 70.38 76.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.307 0.575 . . . . 1.0 110.427 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' HIS . . . . . 0.41 ' ND1' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -72.14 51.11 0.23 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.302 -0.863 . . . . 1.0 111.338 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.6 -27.07 0.22 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.536 -0.84 . . . . 1.0 112.62 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.89 26.81 3.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.759 0.314 . . . . 1.0 110.997 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.785 ' HB3' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -49.91 176.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.053 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.572 ' HB3' HD11 ' A' ' 21' ' ' LEU . 41.5 t -55.37 -101.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.671 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' O ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -70.78 75.5 0.61 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.924 0.392 . . . . 1.0 110.707 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 33.05 33.95 0.02 OUTLIER Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.92 -0.582 . . . . 1.0 113.546 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.785 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -69.33 150.73 47.03 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 120.911 0.386 . . . . 1.0 111.181 -179.498 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -101.85 164.22 11.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.655 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.17 115.53 30.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.704 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.483 ' CD2' HG11 ' A' ' 34' ' ' VAL . 23.4 m0 -99.99 100.82 11.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.7 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.71 141.55 28.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.845 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 125.17 50.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.435 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -44.44 -30.18 0.82 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.414 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.3 -67.43 0.92 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.761 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p -69.24 179.31 2.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 1.0 111.118 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -162.23 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 1.0 111.249 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.43 139.12 53.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.54 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 8' ' ' LYS . 2.4 m -133.03 163.69 37.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.279 -0.419 . . . . 1.0 111.167 -179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.45 150.5 21.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.933 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.483 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.6 p -150.84 137.28 11.22 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.998 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.748 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.9 Cg_endo -58.67 140.28 94.27 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.993 2.462 . . . . 1.0 112.564 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -43.14 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.995 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.02 -179.854 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.779 0.323 . . . . 1.0 111.199 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -60.28 155.88 16.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.85 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -66.04 178.3 1.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 1.0 110.989 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.63 HD13 ' N ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER -70.08 121.11 81.93 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.102 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.96 141.22 93.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.22 1.947 . . . . 1.0 111.706 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 pttm -71.69 154.19 41.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.908 0.385 . . . . 1.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 20.5 m95 56.04 28.77 13.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.027 -0.533 . . . . 1.0 111.311 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.678 ' C ' HG12 ' A' ' 32' ' ' VAL . 2.0 tptt -109.85 152.59 25.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.417 . . . . 1.0 110.754 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.69 162.83 0.05 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.219 -0.515 . . . . 1.0 113.214 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.15 -8.58 35.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.547 0.213 . . . . 1.0 111.498 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.5 HG12 ' N ' ' A' ' 12' ' ' ASN . 22.0 t -41.19 159.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.473 -0.33 . . . . 1.0 111.413 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.5 ' N ' HG12 ' A' ' 11' ' ' VAL . 56.8 t-20 75.2 83.36 0.1 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.979 0.418 . . . . 1.0 110.285 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 12' ' ' ASN . 21.9 mmt-85 83.21 -16.71 0.55 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.482 -0.781 . . . . 1.0 112.07 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.61 87.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.796 0.332 . . . . 1.0 111.276 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.03 34.46 2.76 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.664 -0.779 . . . . 1.0 112.536 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.95 24.89 7.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.652 0.263 . . . . 1.0 111.048 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.2 m -42.91 150.45 0.16 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.056 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.2 t -70.13 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.91 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.438 ' N ' HD11 ' A' ' 21' ' ' LEU . 7.6 mt-10 -61.89 -154.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.231 -0.285 . . . . 1.0 110.231 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.55 28.46 2.08 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.753 -0.736 . . . . 1.0 112.941 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.798 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.77 144.19 52.76 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.715 0.293 . . . . 1.0 110.624 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.624 ' O ' HG22 ' A' ' 34' ' ' VAL . 9.8 pt-20 -106.65 137.15 45.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 1.0 111.002 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.95 112.4 20.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.992 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.465 ' CD2' HG21 ' A' ' 34' ' ' VAL . 31.4 m0 -95.1 122.13 37.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -84.8 133.86 34.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.871 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.64 -159.69 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.591 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -51.47 52.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.348 -0.387 . . . . 1.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.52 -43.11 1.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.905 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 p -57.53 177.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.15 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' CD1' ' N ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -66.04 -167.14 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.463 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -111.04 161.32 16.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.403 179.615 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.678 HG12 ' C ' ' A' ' 8' ' ' LYS . 2.0 m -131.74 127.66 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 1.0 111.179 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.6 m -61.73 127.4 31.24 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.768 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.624 HG22 ' O ' ' A' ' 22' ' ' GLU . 14.6 m -124.68 115.04 26.83 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.759 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.798 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.3 Cg_endo -59.16 134.52 59.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.622 2.215 . . . . 1.0 112.69 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.993 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.442 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -70.17 139.87 87.73 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.556 -0.293 . . . . 1.0 110.598 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 57.5 Cg_endo -92.67 -88.93 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 122.944 2.43 . . . . 1.0 112.529 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.27 -78.6 0.07 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.783 0.325 . . . . 1.0 111.115 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 66.6 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.227 -0.892 . . . . 1.0 110.946 -179.952 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.822 0.344 . . . . 1.0 111.397 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -60.15 119.09 7.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.847 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.02 177.71 0.23 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.282 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.754 HG22 ' HD2' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -70.34 147.66 95.25 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.721 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.754 ' HD2' HG22 ' A' ' 4' ' ' ILE . 1.7 Cg_endo -79.83 119.6 4.04 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.563 2.175 . . . . 1.0 111.461 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.89 145.23 46.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.896 0.379 . . . . 1.0 111.009 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 9.4 m95 59.7 49.21 8.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.997 -0.547 . . . . 1.0 111.501 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.713 ' O ' HG13 ' A' ' 32' ' ' VAL . 2.8 mmtp -141.89 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.868 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.48 145.36 1.34 Allowed Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.005 -0.543 . . . . 1.0 113.191 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -95.66 0.76 53.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.386 0.143 . . . . 1.0 111.386 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.511 HG22 ' CE2' ' A' ' 30' ' ' PHE . 21.7 t -53.58 86.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 120.977 0.418 . . . . 1.0 111.559 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.1 t-20 175.41 81.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.415 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 mmt-85 68.57 10.58 7.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.19 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 45.98 71.19 0.31 Allowed 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.899 0.381 . . . . 1.0 111.445 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 123.95 40.75 0.44 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.62 -0.8 . . . . 1.0 113.012 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -100.46 23.02 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.427 0.156 . . . . 1.0 110.931 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 29.8 m -47.25 151.83 0.66 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.642 -0.254 . . . . 1.0 110.889 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.41 ' N ' HG12 ' A' ' 4' ' ' ILE . 28.3 t -67.81 -97.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.15 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' HG3' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.87 -155.03 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.214 -0.291 . . . . 1.0 110.214 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.88 31.37 0.75 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.651 -0.785 . . . . 1.0 114.346 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.674 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -78.16 147.14 34.67 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 117.591 0.696 . . . . 1.0 110.603 179.358 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -102.85 150.82 23.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.0 t -91.19 112.41 24.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.0 m0 -105.68 163.66 12.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.988 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.7 ptmt -116.68 151.71 35.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.911 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.41 126.09 53.08 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.591 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -38.67 4.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.946 -0.57 . . . . 1.0 111.074 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.78 -68.11 0.83 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.902 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.58 176.19 3.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.511 ' CE2' HG22 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.25 -152.67 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.913 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.405 ' C ' HG23 ' A' ' 32' ' ' VAL . 37.1 mt-10 -95.56 160.35 14.55 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 120.664 0.268 . . . . 1.0 110.687 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.713 HG13 ' O ' ' A' ' 8' ' ' LYS . 99.8 t -155.93 140.33 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.461 -0.336 . . . . 1.0 111.278 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 20.3 m -75.05 139.01 42.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.257 -0.429 . . . . 1.0 110.513 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 34' ' ' VAL . 29.0 m -128.29 120.92 21.28 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-O 120.491 0.186 . . . . 1.0 111.284 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HB3' HD23 ' A' ' 21' ' ' LEU . 36.6 Cg_endo -61.34 141.86 94.02 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.04 2.494 . . . . 1.0 112.325 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -48.73 -76.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 37' ' ' THR . 5.6 t -69.77 110.56 6.75 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.23 71.42 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.736 2.291 . . . . 1.0 112.249 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.31 -63.69 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 1.0 111.198 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.225 -0.893 . . . . 1.0 111.049 179.871 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.836 0.351 . . . . 1.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -60.34 86.27 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -65.85 168.28 8.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.224 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.767 HG21 ' HA ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -70.11 125.13 91.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.529 -0.305 . . . . 1.0 111.255 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.13 124.39 14.29 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.492 2.128 . . . . 1.0 112.119 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.465 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.88 -170.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.03 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.465 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 31.5 p-90 43.09 47.6 5.19 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.301 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.404 ' CD ' ' C ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -134.13 158.55 43.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.584 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.15 143.61 28.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.686 -0.769 . . . . 1.0 112.255 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 2.2 p -116.14 34.39 5.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.799 0.333 . . . . 1.0 111.31 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.56 128.23 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.329 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 59.5 18.92 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.279 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 mmm180 -149.66 66.2 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.256 0.55 . . . . 1.0 110.801 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.73 50.32 0.83 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.674 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 171.66 33.01 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.783 -0.723 . . . . 1.0 113.045 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.42 4.45 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.517 0.199 . . . . 1.0 110.628 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.767 ' HA ' HG21 ' A' ' 4' ' ' ILE . 86.6 m -70.34 148.52 48.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.788 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.446 ' N ' HG22 ' A' ' 4' ' ' ILE . 12.5 t -69.96 -93.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.366 -0.379 . . . . 1.0 110.897 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.41 -159.6 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.6 0.238 . . . . 1.0 110.747 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.29 41.38 2.46 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.587 -0.816 . . . . 1.0 112.751 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.573 HD23 ' CA ' ' A' ' 35' ' ' PRO . 1.2 mp -69.84 164.84 22.81 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 120.972 0.415 . . . . 1.0 111.389 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.544 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.7 OUTLIER -135.24 134.01 39.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.661 179.801 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.18 107.36 9.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.942 0.401 . . . . 1.0 110.82 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -93.45 126.12 38.42 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.292 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -74.17 136.98 42.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.467 . . . . 1.0 110.812 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -91.21 -162.97 0.97 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.584 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -70.03 -66.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 1.0 110.904 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.21 -52.37 2.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.79 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.88 171.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.962 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -68.6 -157.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.761 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 5.4 pt-20 -102.3 138.41 39.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 1.0 110.909 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.1 m -109.6 135.17 49.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.113 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 21' ' ' LEU . 14.2 t -59.72 135.85 57.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.093 -0.503 . . . . 1.0 111.414 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' GLU . 12.4 p -143.05 132.91 11.97 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-O 120.715 0.293 . . . . 1.0 111.363 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.573 ' CA ' HD23 ' A' ' 21' ' ' LEU . 32.6 Cg_endo -59.97 140.14 91.34 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.922 2.414 . . . . 1.0 112.576 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -66.37 -47.04 74.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.988 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.7 HG22 ' HD2' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -70.08 151.88 95.94 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.89 -0.595 . . . . 1.0 110.939 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.7 ' HD2' HG22 ' A' ' 37' ' ' THR . 3.6 Cg_exo -76.82 86.24 1.63 Allowed 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.853 2.369 . . . . 1.0 112.126 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.8 138.59 58.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.933 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.5 m . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.197 -0.906 . . . . 1.0 110.815 -179.913 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.592 0.234 . . . . 1.0 111.26 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.26 122.79 14.06 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.047 0.451 . . . . 1.0 110.96 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.15 163.76 5.89 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.044 -0.526 . . . . 1.0 111.061 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.415 ' CD1' ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -70.05 147.37 95.69 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 1.0 111.216 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 19.2 Cg_exo -64.11 130.7 28.05 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.622 2.215 . . . . 1.0 111.955 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.17 149.86 27.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 1.0 110.661 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.4 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 0.2 OUTLIER 63.11 36.42 12.22 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.836 -179.588 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -101.19 149.95 23.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.477 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.519 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -45.58 173.83 0.01 OUTLIER Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.3 -0.476 . . . . 1.0 113.531 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.427 ' O ' ' N ' ' A' ' 12' ' ' ASN . 19.3 t -104.45 -12.63 16.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.585 0.231 . . . . 1.0 111.424 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.97 82.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.993 0.425 . . . . 1.0 111.206 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 10' ' ' CYS . 6.0 t-20 177.46 75.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.473 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.412 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.0 OUTLIER 65.51 14.99 9.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.421 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 48.28 84.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.786 0.327 . . . . 1.0 111.334 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 109.37 53.31 0.6 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.58 -0.819 . . . . 1.0 112.517 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -111.43 20.73 16.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.562 0.22 . . . . 1.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' ' CD1' ' A' ' 4' ' ' ILE . 4.2 m -61.9 163.71 7.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.514 -0.312 . . . . 1.0 110.444 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.6 t -55.35 -94.71 0.0 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.77 -0.195 . . . . 1.0 110.798 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -66.64 -154.94 0.01 OUTLIER 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.1 -0.333 . . . . 1.0 110.1 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.49 33.27 1.59 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 1.0 113.001 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.814 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -69.71 151.47 45.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.93 0.365 . . . . 1.0 111.138 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.739 ' O ' HG12 ' A' ' 34' ' ' VAL . 1.5 pm0 -118.67 134.48 55.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.165 0.507 . . . . 1.0 110.291 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 14.6 p -79.1 126.9 31.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 33.0 m0 -108.78 135.99 49.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.011 -0.54 . . . . 1.0 111.203 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.5 tptm -90.1 134.65 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.458 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 174.93 5.67 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.084 0.468 . . . . 1.0 110.673 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -73.05 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.804 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -71.01 -66.98 0.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.548 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 p -69.28 152.14 45.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.213 -0.448 . . . . 1.0 110.714 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -147.11 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.731 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 8.5 mt-10 -89.92 169.44 11.23 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.841 0.353 . . . . 1.0 110.756 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.71 139.9 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 33.8 m -69.97 140.37 52.97 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.176 -0.466 . . . . 1.0 111.059 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 22' ' ' GLU . 7.2 p -143.2 138.24 15.48 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.674 -0.239 . . . . 1.0 111.095 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.814 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.3 Cg_endo -58.16 139.92 92.28 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.927 2.418 . . . . 1.0 112.747 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -51.18 -39.05 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 1.0 110.974 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.535 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 8.8 t -65.11 145.5 99.08 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.901 -0.591 . . . . 1.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 3.0 Cg_exo -75.38 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.668 2.245 . . . . 1.0 112.087 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -67.05 130.84 44.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.988 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.496 ' O ' HG22 ' A' ' 40' ' ' THR . 7.4 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.108 -0.948 . . . . 1.0 110.788 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.943 0.401 . . . . 1.0 111.244 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.25 116.18 4.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 2.4 m -70.16 -95.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.702 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 17' ' ' CYS . 11.0 tt -70.63 140.98 87.22 Favored Pre-proline 0 N--CA 1.455 -0.183 0 O-C-N 122.393 -0.192 . . . . 1.0 110.798 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 44.3 Cg_exo -54.19 113.18 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.085 1.857 . . . . 1.0 111.828 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.23 145.67 46.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.875 0.369 . . . . 1.0 110.806 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.8 m0 67.68 19.35 9.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.805 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.535 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -110.23 173.8 6.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.729 0.299 . . . . 1.0 110.806 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.3 150.94 28.68 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.836 -0.697 . . . . 1.0 112.63 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 12' ' ' ASN . 21.0 p -115.1 19.06 15.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.475 0.179 . . . . 1.0 111.311 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.47 82.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.85 0.357 . . . . 1.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 10' ' ' CYS . 4.6 t-20 177.59 81.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.568 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 73.84 5.47 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.742 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 46.23 83.63 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 120.888 0.375 . . . . 1.0 111.33 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.08 34.41 0.89 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.596 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.64 22.03 13.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.664 0.269 . . . . 1.0 110.858 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.478 ' HA ' HG21 ' A' ' 4' ' ' ILE . 11.6 m -58.41 165.59 2.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 1.0 110.674 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 39.5 t -70.24 -88.57 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.387 -0.369 . . . . 1.0 111.915 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -67.88 66.47 0.1 Allowed 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.879 0.371 . . . . 1.0 111.702 -178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 39.97 26.64 0.1 Allowed Glycine 0 C--O 1.225 -0.433 0 C-N-CA 121.228 -0.511 . . . . 1.0 113.817 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.27 151.16 46.6 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 120.983 0.42 . . . . 1.0 110.576 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -101.54 159.03 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 1.0 110.774 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.8 t -98.51 120.25 38.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.921 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.592 ' CD2' HG11 ' A' ' 34' ' ' VAL . 30.7 m0 -109.69 130.98 55.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.69 148.29 25.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.7 mmt-85 -114.03 129.51 56.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.643 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.13 -30.39 1.12 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.448 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 -82.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.63 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.6 p -70.14 -177.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.915 0.388 . . . . 1.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -153.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.662 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -113.32 136.83 52.33 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.806 0.336 . . . . 1.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.535 HG12 ' C ' ' A' ' 8' ' ' LYS . 9.7 m -126.04 163.99 26.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.302 -0.408 . . . . 1.0 111.374 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.3 m -69.23 161.07 29.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.738 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.592 HG11 ' CD2' ' A' ' 24' ' ' TRP . 8.9 p -170.33 138.16 1.36 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.382 -0.372 . . . . 1.0 110.938 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HD2' HG23 ' A' ' 34' ' ' VAL . 18.5 Cg_endo -53.85 136.04 64.8 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.004 2.469 . . . . 1.0 112.554 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -89.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.326 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -70.21 142.46 89.93 Favored Pre-proline 0 CA--C 1.53 0.188 0 O-C-N 122.397 -0.19 . . . . 1.0 110.926 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 9.2 Cg_endo -88.36 150.11 6.55 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.102 2.535 . . . . 1.0 112.079 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.61 82.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.302 -0.408 . . . . 1.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.31 -0.852 . . . . 1.0 110.848 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.92 0.391 . . . . 1.0 111.289 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -58.6 124.76 20.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.934 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.4 m -66.0 147.75 52.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.328 -0.396 . . . . 1.0 110.776 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 17' ' ' CYS . 2.1 pp -70.1 141.76 89.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.229 . . . . 1.0 111.207 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -68.45 140.24 47.43 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.534 2.156 . . . . 1.0 111.95 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -71.72 162.95 28.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 24.3 m0 60.14 31.48 20.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.024 -0.535 . . . . 1.0 111.271 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -120.06 147.72 44.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.517 179.867 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.666 ' CA ' HG12 ' A' ' 32' ' ' VAL . . . -71.07 136.68 25.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.059 -0.591 . . . . 1.0 112.845 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -94.32 27.45 2.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.689 0.281 . . . . 1.0 111.009 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.1 p -67.6 70.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 1.0 110.987 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -177.22 -70.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.455 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 7.5 mmm180 -95.84 -9.49 31.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.342 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 53.63 92.41 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-O 121.087 0.47 . . . . 1.0 110.832 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.72 48.81 4.81 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.238 -179.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.464 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 0.0 OUTLIER -88.08 5.27 41.9 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.515 -0.342 . . . . 1.0 111.204 -179.113 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 21' ' ' LEU . 57.3 m -45.69 138.8 4.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.946 0.403 . . . . 1.0 111.779 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 t -70.4 -83.31 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.377 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' H ' HD11 ' A' ' 21' ' ' LEU . 14.2 mt-10 -63.79 -153.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.608 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 17.98 3.34 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.625 -0.797 . . . . 1.0 113.173 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.535 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.69 144.3 52.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.098 0.449 . . . . 1.0 110.525 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -116.07 160.01 20.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 1.0 110.928 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -91.61 109.71 21.02 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.85 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 36.9 m0 -115.64 149.54 38.16 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.29 -0.413 . . . . 1.0 111.291 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -70.7 128.4 35.94 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.006 -0.543 . . . . 1.0 110.93 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.529 ' HD2' HG21 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.88 -162.61 0.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.563 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -68.12 0.44 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.794 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 ttp-105 -103.89 -43.08 5.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.9 p -67.73 157.37 34.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.996 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -158.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.433 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 44.0 mt-10 -80.26 124.56 28.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 120.978 0.418 . . . . 1.0 110.887 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.666 HG12 ' CA ' ' A' ' 9' ' ' GLY . 34.7 m -117.3 160.99 16.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 1.0 111.048 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 5.0 m -69.51 142.41 53.69 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.284 -0.416 . . . . 1.0 111.131 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 22' ' ' GLU . 13.0 p -142.34 120.16 7.37 Favored Pre-proline 0 C--N 1.323 -0.557 0 C-N-CA 122.195 0.198 . . . . 1.0 111.073 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.6 Cg_endo -57.94 139.08 89.13 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.858 2.372 . . . . 1.0 112.475 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.94 -35.83 2.18 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.116 -0.493 . . . . 1.0 111.137 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.43 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 75.8 m -69.87 121.4 82.62 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.639 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 2.5 Cg_endo -80.12 -75.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.808 2.339 . . . . 1.0 112.24 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -70.23 83.27 0.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.992 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.158 -0.925 . . . . 1.0 110.97 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.035 0.445 . . . . 1.0 111.147 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -60.62 137.04 58.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.222 -0.444 . . . . 1.0 111.004 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.35 -176.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.03 142.33 90.29 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.188 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.17 124.88 15.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.512 2.141 . . . . 1.0 111.983 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -70.16 150.38 46.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 7' ' ' TRP . 2.0 m0 67.33 27.27 8.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 1.0 111.184 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.04 169.05 9.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.426 -0.352 . . . . 1.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 152.15 46.48 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.662 -0.78 . . . . 1.0 112.569 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.91 5.48 49.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.407 0.151 . . . . 1.0 111.407 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.5 p -70.93 65.41 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.085 0.469 . . . . 1.0 110.861 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -177.32 -54.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.871 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.427 ' HB3' ' CB ' ' A' ' 16' ' ' ASP . 1.0 OUTLIER -97.91 -38.28 9.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.814 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.26 84.88 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.049 -0.523 . . . . 1.0 111.448 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.13 -0.88 71.86 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.742 -0.742 . . . . 1.0 113.259 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.427 ' CB ' ' HB3' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -98.14 24.13 7.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.985 0.421 . . . . 1.0 110.65 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 172.63 0.03 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.035 -0.53 . . . . 1.0 111.052 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.6 t -64.62 -96.7 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.533 -0.303 . . . . 1.0 111.164 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 21' ' ' LEU . 3.2 mm-40 -65.78 -164.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 N-CA-C 110.202 -0.296 . . . . 1.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.28 39.53 0.86 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.646 -0.788 . . . . 1.0 112.779 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.4 OUTLIER -69.82 155.14 40.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 120.819 0.343 . . . . 1.0 111.157 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.524 ' OE1' HG23 ' A' ' 34' ' ' VAL . 0.2 OUTLIER -127.98 135.81 50.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.598 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.5 m -74.78 127.59 33.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.009 -0.541 . . . . 1.0 111.134 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.468 ' CD2' HG21 ' A' ' 34' ' ' VAL . 18.9 m0 -119.28 133.95 55.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.877 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -83.14 148.07 27.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.768 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.835 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -76.16 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.133 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.44 -59.45 2.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.464 . . . . 1.0 110.923 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.58 162.25 3.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.736 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -82.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.792 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -159.53 144.38 15.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 1.0 111.073 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.9 m -125.94 143.23 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.287 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 148.92 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.249 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.524 HG23 ' OE1' ' A' ' 22' ' ' GLU . 2.2 m -147.46 132.87 9.21 Favored Pre-proline 0 C--N 1.323 -0.562 0 C-N-CA 122.401 0.281 . . . . 1.0 111.245 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -57.27 136.37 75.9 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.875 2.383 . . . . 1.0 112.685 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -68.96 -45.7 70.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.02 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 37' ' ' THR . 10.1 t -47.1 104.94 0.44 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.446 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.57 -157.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.757 2.305 . . . . 1.0 112.217 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 149.28 29.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.926 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.237 -0.887 . . . . 1.0 110.89 179.962 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.838 0.352 . . . . 1.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -60.14 149.58 32.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.876 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.98 163.71 11.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.223 -0.444 . . . . 1.0 111.307 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.576 HG23 ' O ' ' A' ' 4' ' ' ILE . 8.0 tp -70.18 116.38 43.99 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 111.291 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.48 117.59 4.33 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.391 2.061 . . . . 1.0 111.885 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.62 169.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.18 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 25.4 m95 61.82 38.15 14.97 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.075 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.25 164.34 30.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.78 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.73 136.22 47.71 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.757 -0.735 . . . . 1.0 112.539 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.4 p -117.36 21.83 12.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.654 0.264 . . . . 1.0 111.275 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -59.05 87.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.901 0.381 . . . . 1.0 111.101 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -176.84 78.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 70.75 5.18 5.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.83 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 44.24 83.04 0.03 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.015 0.436 . . . . 1.0 111.412 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.25 10.29 1.96 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.67 -0.776 . . . . 1.0 113.143 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.89 11.84 23.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.226 0.513 . . . . 1.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' HG21 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -57.76 179.63 0.06 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 1.0 110.891 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.8 t -68.99 -95.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.692 -0.231 . . . . 1.0 111.036 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 -155.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.212 -0.292 . . . . 1.0 110.212 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.76 34.71 2.31 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.725 -0.75 . . . . 1.0 112.784 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.759 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.48 152.77 44.46 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 120.781 0.324 . . . . 1.0 111.023 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.3 pt-20 -116.85 158.39 24.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.917 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.0 m -86.69 113.85 22.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.902 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.797 ' CD2' HG11 ' A' ' 34' ' ' VAL . 18.8 m0 -108.4 136.4 48.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.822 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -88.18 150.85 23.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.037 0.446 . . . . 1.0 110.948 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -110.39 122.58 48.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.679 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -46.31 -40.5 11.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.275 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -92.51 -75.94 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -176.11 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.153 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -149.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 1.0 110.728 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.33 176.1 7.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.764 0.316 . . . . 1.0 110.677 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -170.11 144.81 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.451 -0.341 . . . . 1.0 111.388 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 153.63 40.03 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.96 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.797 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.1 p -146.53 137.23 12.48 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 116.727 -0.215 . . . . 1.0 111.547 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.759 ' HA ' HD23 ' A' ' 21' ' ' LEU . 36.8 Cg_endo -61.36 145.79 97.91 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.953 2.435 . . . . 1.0 112.464 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -131.54 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.331 -0.395 . . . . 1.0 110.48 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 68.5 m -70.27 143.56 91.06 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.614 0.245 . . . . 1.0 110.878 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 63.3 Cg_endo -88.45 -49.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 122.71 2.273 . . . . 1.0 112.864 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -55.84 112.88 1.28 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.489 -0.323 . . . . 1.0 111.102 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.198 -0.906 . . . . 1.0 110.798 179.935 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 121.162 0.506 . . . . 1.0 111.171 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.5 p-10 -60.18 118.03 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.812 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.2 177.11 0.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.178 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.561 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.6 pp -58.15 161.23 7.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.515 -0.311 . . . . 1.0 111.375 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -81.97 112.16 2.29 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.019 2.479 . . . . 1.0 111.774 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 pttt -58.3 155.48 11.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.918 0.389 . . . . 1.0 111.163 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.4 m95 60.38 43.38 13.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.349 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' C ' HG12 ' A' ' 32' ' ' VAL . 4.6 mmtp -142.6 170.16 16.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.94 162.85 6.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.77 -0.729 . . . . 1.0 112.607 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.407 ' O ' ' N ' ' A' ' 12' ' ' ASN . 3.2 m -127.03 19.23 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.426 0.155 . . . . 1.0 111.302 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 t -57.42 85.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.78 0.324 . . . . 1.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 10' ' ' CYS . 30.4 t-20 179.76 80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 1.0 110.526 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 68.28 13.59 9.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.264 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.94 37.1 4.55 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.406 -0.361 . . . . 1.0 111.455 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 174.15 37.23 0.04 OUTLIER Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.999 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.8 15.04 29.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.531 0.205 . . . . 1.0 110.962 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.12 174.86 4.99 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.587 -0.278 . . . . 1.0 110.655 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.402 ' HB3' HD11 ' A' ' 21' ' ' LEU . 51.3 t -70.03 -105.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.753 -0.203 . . . . 1.0 111.045 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.43 ' N ' HD11 ' A' ' 21' ' ' LEU . 6.4 mm-40 -60.23 -161.47 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.163 -0.31 . . . . 1.0 110.163 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.48 39.41 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.413 -0.899 . . . . 1.0 112.87 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.661 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -70.01 147.95 49.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.823 0.344 . . . . 1.0 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.3 OUTLIER -117.03 153.56 32.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.003 0.43 . . . . 1.0 110.647 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.19 114.37 26.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.282 -0.417 . . . . 1.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -103.47 129.8 50.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.075 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -84.64 134.66 34.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.704 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -163.55 0.85 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.353 . . . . 1.0 110.641 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -79.7 0.06 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.636 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.47 -39.25 10.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.593 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.97 167.99 4.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.846 -0.616 . . . . 1.0 111.024 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -156.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -107.35 155.08 20.39 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.828 0.346 . . . . 1.0 110.721 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.426 HG12 ' C ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -141.18 138.57 33.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.315 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.65 155.26 16.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.609 HG12 ' O ' ' A' ' 22' ' ' GLU . 5.9 p -155.28 116.72 2.36 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.024 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.661 ' HB3' HD23 ' A' ' 21' ' ' LEU . 30.7 Cg_endo -60.0 137.76 77.89 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.764 2.309 . . . . 1.0 112.596 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.2 -67.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.907 -0.588 . . . . 1.0 111.436 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.7 t -70.44 147.81 95.12 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.543 -0.298 . . . . 1.0 111.075 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.23 -64.27 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.822 2.348 . . . . 1.0 112.151 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.49 114.28 3.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.966 -0.561 . . . . 1.0 111.001 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.4 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.073 -0.965 . . . . 1.0 110.861 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.953 0.406 . . . . 1.0 111.096 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.5 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.164 -0.471 . . . . 1.0 111.21 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.5 m -69.76 143.75 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.433 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.441 HD12 ' O ' ' A' ' 5' ' ' PRO . 2.5 pp -70.1 144.7 93.0 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.402 -0.363 . . . . 1.0 111.287 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.441 ' O ' HD12 ' A' ' 4' ' ' ILE . 41.9 Cg_exo -55.11 140.71 80.65 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.382 2.055 . . . . 1.0 112.052 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 18.0 pttt -96.02 30.81 2.3 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.996 0.427 . . . . 1.0 111.198 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 8.6 m95 -148.21 29.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.754 -0.657 . . . . 1.0 110.737 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.753 ' O ' HG23 ' A' ' 32' ' ' VAL . 27.9 mmtm -118.68 161.69 19.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.385 . . . . 1.0 110.999 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 31' ' ' GLU . . . -54.71 -179.16 0.18 Allowed Glycine 0 C--N 1.329 0.163 0 C-N-CA 121.053 -0.594 . . . . 1.0 112.434 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 31' ' ' GLU . 1.6 t -131.86 11.03 4.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 111.607 0.225 . . . . 1.0 111.607 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 11' ' ' VAL . 13.0 p -77.32 55.07 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.949 0.404 . . . . 1.0 111.092 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 51.5 t-20 172.96 -36.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.111 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mmt-85 -81.46 -52.18 7.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.779 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 51.43 67.05 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.121 0.486 . . . . 1.0 110.937 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.55 26.08 66.3 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.813 -0.708 . . . . 1.0 112.271 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.77 23.43 11.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.619 0.247 . . . . 1.0 110.919 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 4' ' ' ILE . 3.5 m -58.65 167.56 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 1.0 110.388 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -60.31 -85.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.531 -179.775 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.432 ' N ' ' SG ' ' A' ' 18' ' ' CYS . 22.9 mt-10 -70.34 -161.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.06 37.76 1.32 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.373 -0.918 . . . . 1.0 112.342 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.0 154.2 42.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.069 0.461 . . . . 1.0 110.95 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.575 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -109.72 149.86 29.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.315 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.25 98.74 9.97 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 1.0 110.537 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.656 ' CD2' HG11 ' A' ' 34' ' ' VAL . 42.6 m0 -76.74 133.55 39.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 1.0 111.131 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -84.56 165.82 17.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.777 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 148.79 35.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.696 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -56.12 -54.57 43.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.995 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 mtp85 -70.32 -80.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 1.0 110.624 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 p -70.12 163.04 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.765 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -80.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.419 ' O ' ' HA2' ' A' ' 9' ' ' GLY . 18.2 mt-10 -154.82 -167.97 2.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.743 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.753 HG23 ' O ' ' A' ' 8' ' ' LYS . 7.3 p -170.28 142.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 1.0 111.027 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.8 m -67.01 159.99 27.47 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.502 -0.317 . . . . 1.0 110.621 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.656 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.7 p -173.18 137.55 0.77 Allowed Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 111.613 0.227 . . . . 1.0 111.613 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.815 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.2 Cg_endo -59.01 140.86 97.23 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.955 2.437 . . . . 1.0 112.418 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -60.34 -78.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.537 HG22 HG23 ' A' ' 40' ' ' THR . 80.0 m -70.21 107.89 2.88 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.347 -0.388 . . . . 1.0 110.792 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 9.2 Cg_endo -88.16 -77.87 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.229 0 C-N-CA 122.976 2.45 . . . . 1.0 112.333 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 124.09 23.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.404 -0.362 . . . . 1.0 110.927 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.537 HG23 HG22 ' A' ' 37' ' ' THR . 1.5 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.206 -0.902 . . . . 1.0 110.843 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.801 0.334 . . . . 1.0 111.268 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.17 74.13 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.127 -0.488 . . . . 1.0 111.221 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.0 157.51 36.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.756 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.847 HD11 ' HG3' ' A' ' 8' ' ' LYS . 0.5 OUTLIER -70.14 117.6 55.85 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.081 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.8 171.78 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.633 2.222 . . . . 1.0 112.852 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 35' ' ' PRO . 34.0 pttt -87.39 50.45 2.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.927 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.454 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.0 m95 -147.99 29.32 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.433 -0.349 . . . . 1.0 111.1 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.847 ' HG3' HD11 ' A' ' 4' ' ' ILE . 9.6 tmtm? -116.69 137.98 51.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.27 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.412 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -50.18 144.87 9.93 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.997 -0.62 . . . . 1.0 112.671 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 p -109.99 7.34 23.67 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.755 0.28 . . . . 1.0 111.755 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.592 HG22 ' OE2' ' A' ' 31' ' ' GLU . 34.8 t -61.95 138.22 22.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.538 0.209 . . . . 1.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.1 t-20 68.88 84.53 0.15 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.207 0.527 . . . . 1.0 109.629 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 1.2 mmm180 76.39 82.32 0.09 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.075 -0.966 . . . . 1.0 109.845 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -67.48 49.74 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.986 -1.006 . . . . 1.0 111.897 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -160.66 22.26 0.24 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 121.169 -0.539 . . . . 1.0 112.356 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -6.86 59.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.616 0.246 . . . . 1.0 110.982 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.836 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.9 t -69.73 -159.81 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.788 -0.449 . . . . 1.0 109.788 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.469 ' N ' ' CG2' ' A' ' 4' ' ' ILE . 42.3 t -70.31 -105.29 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.15 0.426 . . . . 1.0 112.15 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.637 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -70.43 -160.46 0.04 OUTLIER 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.566 0.222 . . . . 1.0 110.851 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.18 47.67 2.66 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.313 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.836 HD13 ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -69.4 144.15 53.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.915 0.388 . . . . 1.0 110.763 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.5 165.68 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.232 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.27 107.2 17.7 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.851 -0.613 . . . . 1.0 110.571 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -102.22 126.97 49.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.83 145.05 29.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.619 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -107.02 123.08 47.68 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -46.31 -29.88 1.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.025 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.57 -70.99 0.73 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.74 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.8 p -70.15 179.59 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.954 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.96 -155.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.967 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' HG22 ' A' ' 11' ' ' VAL . 7.9 mt-10 -99.24 -178.47 3.93 Favored 'General case' 0 N--CA 1.458 -0.071 0 CA-C-N 116.614 -0.267 . . . . 1.0 110.535 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.481 HG22 ' N ' ' A' ' 33' ' ' CYS . 4.8 p -170.21 157.39 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.811 0.339 . . . . 1.0 111.82 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.481 ' N ' HG22 ' A' ' 32' ' ' VAL . 4.5 p -99.54 117.63 34.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.789 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 34' ' ' VAL . 13.5 p -109.32 117.27 53.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.68 -0.236 . . . . 1.0 111.61 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.777 ' HB3' HD23 ' A' ' 21' ' ' LEU . 29.1 Cg_endo -59.79 132.08 43.32 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.843 2.362 . . . . 1.0 113.14 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -70.71 -47.18 61.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.598 -0.728 . . . . 1.0 110.654 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.406 ' OG1' ' HD2' ' A' ' 38' ' ' PRO . 12.9 t -60.86 155.85 50.37 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.959 -0.564 . . . . 1.0 110.998 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.406 ' HD2' ' OG1' ' A' ' 37' ' ' THR . 17.0 Cg_exo -68.09 145.46 67.21 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.693 2.262 . . . . 1.0 112.187 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -177.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.269 -0.423 . . . . 1.0 111.037 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 73.8 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.267 -0.873 . . . . 1.0 110.965 -179.851 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.84 0.352 . . . . 1.0 111.129 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.86 77.55 0.08 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.98 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 m -59.43 172.67 0.62 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.061 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 5' ' ' PRO . 1.8 pp -69.96 140.55 88.72 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.265 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.424 ' O ' HD12 ' A' ' 4' ' ' ILE . 23.7 Cg_exo -62.2 149.96 88.62 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.391 2.06 . . . . 1.0 112.03 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.489 ' HB3' ' CD1' ' A' ' 7' ' ' TRP . 17.4 mtmm -60.53 165.69 3.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 1.0 110.955 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 46.91 69.98 0.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.067 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' GLY . 4.4 tmtm? -129.46 132.15 46.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.839 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.414 ' N ' ' HD3' ' A' ' 8' ' ' LYS . . . -48.94 139.74 12.58 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 121.235 -0.507 . . . . 1.0 112.811 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.8 p -106.04 -3.22 21.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.511 0.196 . . . . 1.0 111.396 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.6 t -83.25 64.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.827 0.346 . . . . 1.0 111.373 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.41 ' N ' ' OD1' ' A' ' 12' ' ' ASN . 1.4 p30 -153.89 -86.87 0.06 Allowed 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.855 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 -88.15 -11.89 45.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.597 0.237 . . . . 1.0 111.32 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 53.81 79.22 0.13 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.0 0.429 . . . . 1.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.67 6.82 6.45 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.818 -0.705 . . . . 1.0 112.743 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -69.89 -13.98 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.991 0.395 . . . . 1.0 111.034 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.45 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 84.8 m -59.23 142.49 51.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.589 -0.278 . . . . 1.0 110.501 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.427 ' HB3' HD11 ' A' ' 21' ' ' LEU . 46.4 t -56.98 -103.36 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.428 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.456 ' N ' HD11 ' A' ' 21' ' ' LEU . 17.0 mm-40 -63.97 -157.19 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.079 -0.341 . . . . 1.0 110.079 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.82 42.4 2.04 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.521 -0.847 . . . . 1.0 112.935 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.684 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -71.68 148.67 46.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.8 0.333 . . . . 1.0 110.894 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -123.84 148.85 46.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.186 0.517 . . . . 1.0 110.856 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 6.8 p -90.79 119.07 30.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.089 -0.505 . . . . 1.0 111.47 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' OE1' ' A' ' 22' ' ' GLU . 35.8 m0 -101.09 125.67 47.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.716 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -73.78 136.51 43.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 1.0 110.475 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.99 -168.45 1.46 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.331 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -46.92 87.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.622 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.71 -42.3 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.636 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.3 t -59.07 173.03 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.011 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.726 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.5 OUTLIER -61.95 -167.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.366 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.26 146.24 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.457 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' HA ' ' A' ' 7' ' ' TRP . 3.9 m -128.36 137.64 56.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.953 0.406 . . . . 1.0 111.377 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -61.77 146.49 49.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.145 -0.479 . . . . 1.0 111.521 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 22' ' ' GLU . 8.8 p -147.12 127.17 6.73 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.896 -0.593 . . . . 1.0 110.831 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.684 ' CA ' HD23 ' A' ' 21' ' ' LEU . 20.0 Cg_endo -56.91 131.12 43.58 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.877 2.385 . . . . 1.0 112.929 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 ptmm? -70.14 -100.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.728 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.41 ' CG2' ' CD ' ' A' ' 38' ' ' PRO . 84.5 m -70.48 149.89 95.62 Favored Pre-proline 0 C--N 1.333 -0.144 0 CA-C-O 120.485 0.183 . . . . 1.0 110.667 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' CD ' ' CG2' ' A' ' 37' ' ' THR . 1.0 OUTLIER -84.2 42.34 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.975 2.45 . . . . 1.0 112.815 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 110.56 5.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.855 0.36 . . . . 1.0 110.768 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 C--O 1.244 0.81 0 CA-C-O 118.37 -0.824 . . . . 1.0 110.727 179.907 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.846 0.355 . . . . 1.0 111.206 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.52 118.35 6.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.173 -0.467 . . . . 1.0 111.077 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -62.17 172.79 1.31 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 1.0 111.04 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.489 HD12 ' C ' ' A' ' 4' ' ' ILE . 1.4 pp -70.13 157.82 88.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.264 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.46 ' C ' HD12 ' A' ' 4' ' ' ILE . 5.1 Cg_exo -75.12 120.01 5.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.781 2.321 . . . . 1.0 111.928 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' C ' ' CG ' ' A' ' 7' ' ' TRP . 12.1 mttt -51.11 148.02 4.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 1.0 111.363 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.44 ' CG ' ' C ' ' A' ' 6' ' ' LYS . 0.7 OUTLIER 44.04 68.94 0.46 Allowed 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 115.859 -0.61 . . . . 1.0 111.98 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 5' ' ' PRO . 36.2 mmtt -148.28 173.81 12.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 1.0 110.831 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -48.31 152.46 2.34 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 121.034 -0.603 . . . . 1.0 112.771 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 31' ' ' GLU . 62.6 m -96.54 0.51 50.21 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.59 0.219 . . . . 1.0 111.59 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.3 p -49.79 89.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 120.936 0.398 . . . . 1.0 111.182 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.6 t-20 173.61 84.49 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 1.0 109.997 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.11 27.71 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 42.71 32.79 0.41 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.948 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.09 37.58 0.04 OUTLIER Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.131 -1.033 . . . . 1.0 113.195 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -107.41 14.75 25.62 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.679 0.276 . . . . 1.0 110.611 179.47 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' HD13 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -57.1 177.23 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.655 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.464 ' HB3' HD11 ' A' ' 21' ' ' LEU . 50.3 t -70.17 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.029 -0.268 . . . . 1.0 111.524 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.66 -152.25 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.614 0.245 . . . . 1.0 110.745 179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.96 37.38 2.52 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.707 -0.759 . . . . 1.0 112.788 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.1 OUTLIER -69.86 145.03 52.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.009 0.433 . . . . 1.0 110.726 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.887 ' HG2' HG23 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -91.7 159.44 15.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.702 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.58 114.46 27.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.864 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.5 m0 -99.28 101.17 12.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.87 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 140.27 36.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 1.0 110.762 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -105.27 117.33 33.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.484 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -45.93 -31.5 2.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.108 -0.496 . . . . 1.0 111.221 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mmt-85 -85.88 -86.62 0.14 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.631 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.0 t -70.39 -164.16 0.08 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.833 0.349 . . . . 1.0 110.856 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -154.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.484 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 10' ' ' CYS . 23.5 mt-10 -109.59 175.64 5.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.666 -0.243 . . . . 1.0 110.368 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.2 t -152.79 139.38 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 1.0 111.706 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 151.46 21.48 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.958 -0.565 . . . . 1.0 110.409 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.887 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 m -145.25 122.52 6.25 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 111.642 0.238 . . . . 1.0 111.642 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 21' ' ' LEU . 38.6 Cg_endo -61.96 142.09 91.7 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.24 2.627 . . . . 1.0 112.54 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.221 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.4 t -69.78 150.11 96.6 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.602 -0.272 . . . . 1.0 111.254 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -73.47 -154.04 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.745 2.297 . . . . 1.0 112.166 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -52.76 106.16 0.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 1.0 110.978 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.176 -0.916 . . . . 1.0 111.039 -179.976 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.816 0.341 . . . . 1.0 111.352 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -59.11 87.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 1.0 110.967 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.93 155.54 19.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.159 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.51 HD12 ' H ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -69.71 172.07 6.11 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.446 ' CD ' ' HB ' ' A' ' 4' ' ' ILE . 13.3 Cg_exo -68.77 116.16 4.3 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.672 2.248 . . . . 1.0 111.851 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -88.99 39.81 0.95 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.268 -179.68 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 43.1 m95 -150.22 22.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.0 110.666 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 mmtm -115.6 158.5 22.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.028 0.442 . . . . 1.0 111.07 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.0 173.67 0.59 Allowed Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.792 -0.64 . . . . 1.0 113.092 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 t -106.55 -2.76 21.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.585 0.231 . . . . 1.0 111.514 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.562 HG13 ' O ' ' A' ' 11' ' ' VAL . 12.7 p -76.88 60.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.944 0.402 . . . . 1.0 111.254 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -178.64 -56.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 1.0 110.728 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -48.19 18.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.17 32.05 10.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.938 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 111.56 4.78 26.52 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.902 -0.666 . . . . 1.0 112.539 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -0.83 50.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.828 0.314 . . . . 1.0 111.312 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.986 ' HB3' HD13 ' A' ' 21' ' ' LEU . 64.0 m -53.35 170.57 0.09 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.682 -0.235 . . . . 1.0 110.761 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.917 ' SG ' HD11 ' A' ' 21' ' ' LEU . 21.8 p -63.43 -123.94 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 121.231 -0.188 . . . . 1.0 111.451 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 21' ' ' LEU . 1.1 mt-10 -46.77 91.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 112.866 0.691 . . . . 1.0 112.866 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' GLU . . . 18.15 45.61 0.01 OUTLIER Glycine 0 C--N 1.337 0.608 0 CA-C-N 114.962 -1.017 . . . . 1.0 115.452 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' A' ' 17' ' ' CYS . 3.0 mp -68.83 161.05 29.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 117.207 0.503 . . . . 1.0 110.894 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -132.89 133.74 43.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.428 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 8.1 p -84.51 115.56 22.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.08 0.467 . . . . 1.0 111.127 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.456 ' CD2' HG21 ' A' ' 34' ' ' VAL . 52.0 m0 -90.19 134.21 34.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.591 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 142.86 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.955 0.407 . . . . 1.0 110.956 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -115.66 135.43 54.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 1.0 110.464 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.98 -50.43 19.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.672 -0.694 . . . . 1.0 111.433 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -89.04 -71.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.19 173.99 6.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.751 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -146.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.516 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -107.63 131.47 54.35 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 110.447 -0.205 . . . . 1.0 110.447 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 23.4 m -115.41 138.57 45.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.632 0.254 . . . . 1.0 111.625 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -66.01 147.12 53.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.545 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.456 HG21 ' CD2' ' A' ' 24' ' ' TRP . 2.4 m -149.92 125.13 4.84 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.704 ' N ' HD23 ' A' ' 21' ' ' LEU . 17.8 Cg_endo -56.61 132.79 53.9 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.768 2.312 . . . . 1.0 112.943 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -70.26 -111.31 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.761 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 37' ' ' THR . 10.0 t -70.38 116.33 43.95 Favored Pre-proline 0 CA--C 1.531 0.232 0 O-C-N 122.297 -0.252 . . . . 1.0 111.028 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -71.62 175.81 9.02 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.726 2.284 . . . . 1.0 112.187 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.3 -73.41 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.432 . . . . 1.0 110.807 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.8 m . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.374 -0.822 . . . . 1.0 111.032 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.79 0.329 . . . . 1.0 111.214 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.43 129.06 39.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.848 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.59 155.46 9.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.198 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.4 pp -63.73 140.38 97.8 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.635 -0.257 . . . . 1.0 111.186 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.0 148.15 93.65 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.528 2.152 . . . . 1.0 112.303 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -95.19 38.51 1.13 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.885 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -156.86 27.99 0.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.701 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.697 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -120.14 166.54 13.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.033 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.49 35.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.725 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.96 26.73 8.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.709 0.29 . . . . 1.0 110.979 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE2' ' A' ' 30' ' ' PHE . 22.0 t -100.6 71.88 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.142 0.496 . . . . 1.0 111.091 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -176.83 -62.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 1.0 110.613 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.68 -46.3 22.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 55.7 87.2 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.05 -12.8 9.77 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.386 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -11.67 61.07 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.642 0.258 . . . . 1.0 111.185 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.3 m -48.44 144.83 3.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.708 -0.224 . . . . 1.0 110.55 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.3 t -59.61 -102.6 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.218 -0.193 . . . . 1.0 111.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.3 -157.59 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 N-CA-C 110.291 -0.263 . . . . 1.0 110.291 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.17 43.12 2.44 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.508 -0.854 . . . . 1.0 112.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.456 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.71 148.72 48.87 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 120.972 0.415 . . . . 1.0 111.216 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -111.76 151.05 29.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 1.0 111.29 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.2 m -78.17 120.21 22.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.673 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.419 ' CD2' HG11 ' A' ' 34' ' ' VAL . 6.9 m0 -119.02 139.37 51.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.863 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -81.67 147.39 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.963 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -120.02 138.81 53.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.104 0.478 . . . . 1.0 110.543 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.12 -57.93 7.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 1.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -71.91 0.42 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.724 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.99 170.3 8.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.845 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.711 ' CE2' HG21 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.24 -145.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.112 -0.495 . . . . 1.0 110.935 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -97.21 126.63 42.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.781 0.324 . . . . 1.0 110.769 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.697 HG12 ' C ' ' A' ' 8' ' ' LYS . 27.6 m -124.15 152.21 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 116.343 -0.389 . . . . 1.0 111.563 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.19 149.05 37.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.215 -0.448 . . . . 1.0 111.173 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.451 HG23 ' HD2' ' A' ' 35' ' ' PRO . 10.8 p -148.58 137.34 11.86 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.527 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.451 ' HD2' HG23 ' A' ' 34' ' ' VAL . 20.9 Cg_endo -56.58 138.27 84.04 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.954 2.436 . . . . 1.0 112.484 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -102.76 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.135 -0.484 . . . . 1.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 63.1 m -70.05 109.25 4.45 Favored Pre-proline 0 C--O 1.232 0.158 0 CA-C-O 120.494 0.188 . . . . 1.0 111.126 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -74.42 149.69 40.02 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 122.719 2.279 . . . . 1.0 112.167 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.7 171.11 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.883 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 69.9 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.233 -0.889 . . . . 1.0 110.917 -179.991 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.771 0.319 . . . . 1.0 111.17 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.42 132.7 48.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.922 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -60.67 141.6 56.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.745 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.471 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.1 pt -60.0 157.48 30.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.503 -0.317 . . . . 1.0 110.648 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.441 ' HB2' ' CE ' ' A' ' 8' ' ' LYS . 52.5 Cg_exo -53.46 96.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 122.385 2.057 . . . . 1.0 112.002 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.76 151.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.29 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.428 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 38.6 m0 63.4 49.88 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.231 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 32' ' ' VAL . 1.5 tptp -117.04 152.76 33.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 1.0 110.809 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.43 158.23 23.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.681 -0.771 . . . . 1.0 112.22 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -3.49 45.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.528 0.204 . . . . 1.0 111.325 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.3 p -69.02 69.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.908 0.385 . . . . 1.0 110.843 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.424 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.6 t-20 -177.97 80.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.054 -0.521 . . . . 1.0 110.506 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.8 OUTLIER 68.22 12.12 8.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.572 . . . . 1.0 111.351 -179.784 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 42.34 79.43 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.859 0.361 . . . . 1.0 111.511 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.81 46.01 0.62 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -96.45 23.79 6.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.906 0.384 . . . . 1.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.724 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.2 m -70.11 144.56 52.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.403 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.734 ' SG ' HD11 ' A' ' 21' ' ' LEU . 1.6 p -55.71 -105.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.568 -0.287 . . . . 1.0 111.748 -179.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -57.28 -155.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.644 0.259 . . . . 1.0 110.812 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.411 ' H ' ' HB2' ' A' ' 19' ' ' GLU . . . -71.49 32.02 0.58 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.766 -0.731 . . . . 1.0 114.429 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.734 HD11 ' SG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -73.13 140.06 46.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.744 0.772 . . . . 1.0 110.186 179.143 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -108.66 162.89 13.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.906 0.384 . . . . 1.0 111.158 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.85 100.38 13.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.729 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 25.7 m0 -100.35 144.64 29.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.073 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.56 133.26 39.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.721 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.97 -172.25 2.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.012 0.434 . . . . 1.0 110.759 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -70.27 -71.52 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.811 -0.632 . . . . 1.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -70.88 -76.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.038 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -58.85 147.49 33.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 1.0 110.835 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.0 110.497 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.64 137.72 51.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.775 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 8' ' ' LYS . 11.2 p -132.8 145.27 34.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.373 -0.376 . . . . 1.0 111.268 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 53.4 m -61.8 137.27 58.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.961 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.52 126.93 7.62 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.801 -0.182 . . . . 1.0 111.348 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -59.53 141.85 97.96 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.92 2.413 . . . . 1.0 112.486 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -49.79 -62.68 1.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.041 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.454 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 75.5 m -69.8 138.23 87.97 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.686 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 47.8 Cg_endo -93.77 66.07 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.644 2.23 . . . . 1.0 112.331 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -66.59 75.79 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.455 . . . . 1.0 110.848 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.7 m . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.219 -0.896 . . . . 1.0 110.921 179.999 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.768 0.318 . . . . 1.0 111.133 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.76 93.93 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.15 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -70.42 -169.84 0.34 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.748 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.6 pp -51.9 141.29 28.27 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 1.0 111.66 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -80.08 158.79 23.74 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.787 2.325 . . . . 1.0 111.862 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -62.04 161.5 10.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.952 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.443 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 42.6 m0 62.78 48.06 4.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.921 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -130.03 142.32 50.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.31 175.81 2.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 1.0 112.641 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.412 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 1.9 t -104.95 1.88 29.21 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.576 0.214 . . . . 1.0 111.576 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.0 p -67.39 68.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 CA-C-O 121.124 0.488 . . . . 1.0 111.11 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -169.95 76.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.591 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 75.61 7.17 3.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.245 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 49.04 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.317 . . . . 1.0 111.35 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.4 38.8 1.07 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.962 -0.637 . . . . 1.0 112.495 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.91 20.42 13.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.649 0.262 . . . . 1.0 111.252 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.477 ' HA ' HD11 ' A' ' 4' ' ' ILE . 58.4 m -55.39 147.3 17.54 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.561 0.219 . . . . 1.0 110.562 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 42.4 t -61.84 -96.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.617 -0.265 . . . . 1.0 110.939 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.504 ' H ' HD11 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -62.56 -154.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.028 -0.36 . . . . 1.0 110.028 179.392 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.47 33.43 1.59 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.594 -0.812 . . . . 1.0 112.896 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.504 HD11 ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.62 157.08 28.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.909 0.385 . . . . 1.0 111.042 -179.745 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 34' ' ' VAL . 1.9 pt-20 -132.2 126.24 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.347 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 13.2 p -69.48 109.69 4.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.084 0.469 . . . . 1.0 111.115 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.4 ' CE3' HG21 ' A' ' 34' ' ' VAL . 51.2 m0 -97.4 143.74 27.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.861 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -67.5 146.89 53.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 1.0 110.895 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -128.01 -177.75 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.575 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -78.51 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.898 -0.592 . . . . 1.0 111.229 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.39 -73.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.331 -0.395 . . . . 1.0 111.12 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -65.59 168.21 7.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.45 -0.341 . . . . 1.0 110.95 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -81.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.42 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.412 ' HG3' ' HB2' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -153.39 136.38 15.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.31 -0.404 . . . . 1.0 110.64 179.907 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.2 m -121.13 141.63 40.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.36 -0.382 . . . . 1.0 111.487 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 79.6 m -58.79 133.35 55.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.02 -0.537 . . . . 1.0 111.323 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 22' ' ' GLU . 5.2 m -137.66 133.32 17.83 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.028 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.2 136.94 75.55 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.971 2.448 . . . . 1.0 112.403 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -51.21 -47.05 62.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.8 m -69.57 109.74 5.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.87 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.42 -161.28 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.626 2.217 . . . . 1.0 112.187 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.56 129.99 43.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.976 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 83.2 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.243 -0.885 . . . . 1.0 110.731 -179.897 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.776 0.322 . . . . 1.0 111.279 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -59.26 105.43 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 1.0 111.217 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.19 153.08 41.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.463 . . . . 1.0 111.18 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 2.3 pp -70.3 143.34 90.69 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.4 -0.364 . . . . 1.0 111.258 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 3.0 Cg_exo -73.65 140.36 29.4 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.553 2.169 . . . . 1.0 111.661 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 1.0 OUTLIER -55.52 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.984 0.421 . . . . 1.0 111.103 -179.848 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.482 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 48.0 p-90 41.14 32.34 0.18 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.748 -0.66 . . . . 1.0 111.344 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.83 143.93 31.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 1.0 111.066 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.58 152.49 51.53 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.574 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.9 m -86.13 -4.74 59.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.641 0.258 . . . . 1.0 111.417 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.415 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.5 t -68.51 72.5 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.957 0.408 . . . . 1.0 110.953 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -176.23 78.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.974 -0.557 . . . . 1.0 110.826 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.46 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 0.9 OUTLIER 74.63 4.33 4.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.642 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 47.13 83.93 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.761 0.315 . . . . 1.0 111.247 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.49 38.21 0.6 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.662 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.443 ' O ' HG21 ' A' ' 4' ' ' ILE . 0.3 OUTLIER -98.97 10.11 42.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.507 0.194 . . . . 1.0 111.295 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HB3' HD13 ' A' ' 21' ' ' LEU . 10.0 m -65.9 152.24 44.93 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.656 -0.247 . . . . 1.0 110.534 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.441 ' HB3' HD11 ' A' ' 21' ' ' LEU . 35.4 t -59.22 -100.64 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.769 -0.196 . . . . 1.0 111.048 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -70.13 -161.65 0.05 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.467 0.175 . . . . 1.0 110.558 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.45 47.88 2.12 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.609 -0.805 . . . . 1.0 112.192 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.08 151.1 45.88 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.968 0.413 . . . . 1.0 111.069 -179.675 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.94 142.9 26.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.988 -0.551 . . . . 1.0 111.222 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 23.0 t -89.24 103.32 15.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.986 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -81.22 90.09 6.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.75 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.96 133.97 33.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.264 0.554 . . . . 1.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -99.12 117.9 34.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.947 -0.57 . . . . 1.0 110.649 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 -43.27 -31.91 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.369 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -59.14 1.99 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.353 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.06 -179.81 2.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.012 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.415 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -70.08 -166.74 0.13 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.009 179.799 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -113.14 160.25 18.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.589 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -160.05 131.42 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.582 -0.281 . . . . 1.0 111.207 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.48 149.33 28.79 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.397 -0.365 . . . . 1.0 111.127 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 35' ' ' PRO . 12.7 p -145.35 136.48 12.52 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 1.0 111.287 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.765 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.8 Cg_endo -58.87 138.63 86.78 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.201 2.601 . . . . 1.0 112.625 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -69.72 -40.01 76.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.159 -0.473 . . . . 1.0 111.076 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.45 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.4 m -64.84 130.88 95.0 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.145 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 58.2 Cg_endo -93.39 99.22 0.15 Allowed 'Trans proline' 0 N--CA 1.445 -1.324 0 C-N-CA 123.095 2.53 . . . . 1.0 112.373 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -59.59 -74.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.116 -0.945 . . . . 1.0 111.01 179.872 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.946 0.403 . . . . 1.0 111.337 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.15 93.36 0.2 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.99 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 4.1 m -70.29 -84.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.018 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.463 HD11 ' SG ' ' A' ' 17' ' ' CYS . 2.2 pp -70.52 158.13 88.47 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.273 . . . . 1.0 111.263 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -59.63 98.37 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.434 2.09 . . . . 1.0 111.646 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -46.33 134.49 8.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.003 0.43 . . . . 1.0 111.576 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 28.3 m0 64.29 75.68 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.173 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -156.5 174.55 15.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.61 179.55 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -55.31 132.13 49.04 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.847 -0.692 . . . . 1.0 112.791 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -98.61 23.64 8.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.623 0.249 . . . . 1.0 111.217 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' CD2' ' A' ' 30' ' ' PHE . 20.1 t -75.62 77.75 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.939 0.4 . . . . 1.0 110.972 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -176.9 78.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 73.6 5.32 4.9 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.211 -0.449 . . . . 1.0 111.691 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.98 34.52 2.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.629 0.252 . . . . 1.0 111.383 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 179.46 35.79 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.411 -0.9 . . . . 1.0 112.816 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.28 14.68 31.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 1.0 110.938 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.463 ' SG ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -70.08 167.62 17.28 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.464 -0.335 . . . . 1.0 111.036 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 42.0 t -67.47 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.236 -0.438 . . . . 1.0 111.45 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -155.12 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.56 0.219 . . . . 1.0 110.639 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.25 34.6 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.618 -0.801 . . . . 1.0 113.282 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.751 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.67 150.24 47.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.9 0.35 . . . . 1.0 110.671 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.445 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.0 pt-20 -126.3 144.27 50.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.066 0.46 . . . . 1.0 111.112 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.4 m -73.88 124.47 26.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.839 -0.619 . . . . 1.0 110.782 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.562 ' CD2' HG11 ' A' ' 34' ' ' VAL . 22.3 m0 -113.73 122.98 48.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.899 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -57.47 150.94 17.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.001 0.429 . . . . 1.0 110.92 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.07 141.53 48.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.547 . . . . 1.0 110.592 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -41.5 66.64 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 1.0 111.134 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.49 -81.97 0.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.785 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.83 -179.84 1.97 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.758 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -69.96 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.52 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 mp0 -140.82 140.25 34.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 1.0 110.753 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -122.98 129.12 75.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 1.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 149.49 40.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.221 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.5 p -147.45 123.59 5.46 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.441 -0.345 . . . . 1.0 111.364 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.751 ' CA ' HD23 ' A' ' 21' ' ' LEU . 29.0 Cg_endo -59.23 138.59 85.74 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.61 2.207 . . . . 1.0 112.651 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -30.2 70.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.892 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.474 HG22 ' HD2' ' A' ' 38' ' ' PRO . 8.2 m -68.07 148.77 98.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.97 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.474 ' HD2' HG22 ' A' ' 37' ' ' THR . 2.9 Cg_endo -85.51 124.62 2.76 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.908 2.406 . . . . 1.0 112.236 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.78 121.38 14.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 1.0 110.817 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.229 -0.891 . . . . 1.0 110.852 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.912 0.387 . . . . 1.0 111.17 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.25 105.42 0.41 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.175 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.13 178.37 2.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.861 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.544 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.5 pp -70.18 158.6 87.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.848 0.356 . . . . 1.0 110.946 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -61.12 93.76 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.476 2.117 . . . . 1.0 112.23 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -61.72 146.68 48.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.787 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 35.3 m95 61.69 38.48 15.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.075 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.765 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.8 mmtm -131.07 -176.14 3.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.879 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.49 -170.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.655 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.41 ' O ' ' ND1' ' A' ' 14' ' ' HIS . 1.6 m -115.06 -4.74 12.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 111.606 0.224 . . . . 1.0 111.606 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 18.9 t -68.2 63.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.848 0.356 . . . . 1.0 111.389 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 56.9 t-20 174.34 83.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.329 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 mmm180 70.38 76.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.307 0.575 . . . . 1.0 110.427 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.41 ' ND1' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -72.14 51.11 0.23 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.302 -0.863 . . . . 1.0 111.338 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.6 -27.07 0.22 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.536 -0.84 . . . . 1.0 112.62 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.89 26.81 3.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.759 0.314 . . . . 1.0 110.997 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.785 ' HB3' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -49.91 176.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.053 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.572 ' HB3' HD11 ' A' ' 21' ' ' LEU . 41.5 t -55.37 -101.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.671 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' O ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -70.78 75.5 0.61 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.924 0.392 . . . . 1.0 110.707 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 33.05 33.95 0.02 OUTLIER Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.92 -0.582 . . . . 1.0 113.546 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.785 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -69.33 150.73 47.03 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 120.911 0.386 . . . . 1.0 111.181 -179.498 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -101.85 164.22 11.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.655 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.17 115.53 30.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.704 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.483 ' CD2' HG11 ' A' ' 34' ' ' VAL . 23.4 m0 -99.99 100.82 11.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.7 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.71 141.55 28.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.845 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 125.17 50.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.435 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -44.44 -30.18 0.82 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.414 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.3 -67.43 0.92 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.761 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p -69.24 179.31 2.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 1.0 111.118 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -162.23 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 1.0 111.249 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.43 139.12 53.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.54 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 8' ' ' LYS . 2.4 m -133.03 163.69 37.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.279 -0.419 . . . . 1.0 111.167 -179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.45 150.5 21.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.933 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.483 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.6 p -150.84 137.28 11.22 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.998 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.748 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.9 Cg_endo -58.67 140.28 94.27 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.993 2.462 . . . . 1.0 112.564 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -43.14 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.995 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.1 t -66.39 153.65 92.34 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -92.15 123.4 0.66 Allowed 'Trans proline' 0 N--CA 1.449 -1.1 0 C-N-CA 123.27 2.647 . . . . 1.0 112.233 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.7 86.45 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.999 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 76.2 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.127 -0.94 . . . . 1.0 110.929 179.92 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.998 0.428 . . . . 1.0 110.989 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.63 HD13 ' N ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER -70.08 121.11 81.93 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.102 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.96 141.22 93.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.22 1.947 . . . . 1.0 111.706 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 pttm -71.69 154.19 41.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.908 0.385 . . . . 1.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 20.5 m95 56.04 28.77 13.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.027 -0.533 . . . . 1.0 111.311 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.678 ' C ' HG12 ' A' ' 32' ' ' VAL . 2.0 tptt -109.85 152.59 25.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.417 . . . . 1.0 110.754 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.69 162.83 0.05 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.219 -0.515 . . . . 1.0 113.214 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.15 -8.58 35.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.547 0.213 . . . . 1.0 111.498 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.5 HG12 ' N ' ' A' ' 12' ' ' ASN . 22.0 t -41.19 159.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.473 -0.33 . . . . 1.0 111.413 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.5 ' N ' HG12 ' A' ' 11' ' ' VAL . 56.8 t-20 75.2 83.36 0.1 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.979 0.418 . . . . 1.0 110.285 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 12' ' ' ASN . 21.9 mmt-85 83.21 -16.71 0.55 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.482 -0.781 . . . . 1.0 112.07 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.61 87.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.796 0.332 . . . . 1.0 111.276 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.03 34.46 2.76 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.664 -0.779 . . . . 1.0 112.536 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.95 24.89 7.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.652 0.263 . . . . 1.0 111.048 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.2 m -42.91 150.45 0.16 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.056 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.2 t -70.13 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.91 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.438 ' N ' HD11 ' A' ' 21' ' ' LEU . 7.6 mt-10 -61.89 -154.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.231 -0.285 . . . . 1.0 110.231 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.55 28.46 2.08 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.753 -0.736 . . . . 1.0 112.941 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.798 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.77 144.19 52.76 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.715 0.293 . . . . 1.0 110.624 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.624 ' O ' HG22 ' A' ' 34' ' ' VAL . 9.8 pt-20 -106.65 137.15 45.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 1.0 111.002 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.95 112.4 20.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.992 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.465 ' CD2' HG21 ' A' ' 34' ' ' VAL . 31.4 m0 -95.1 122.13 37.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -84.8 133.86 34.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.871 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.64 -159.69 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.591 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -51.47 52.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.348 -0.387 . . . . 1.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.52 -43.11 1.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.905 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 p -57.53 177.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.15 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.401 ' CD1' ' N ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -66.04 -167.14 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.463 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -111.04 161.32 16.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.403 179.615 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.678 HG12 ' C ' ' A' ' 8' ' ' LYS . 2.0 m -131.74 127.66 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 1.0 111.179 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.6 m -61.73 127.4 31.24 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.768 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.624 HG22 ' O ' ' A' ' 22' ' ' GLU . 14.6 m -124.68 115.04 26.83 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.759 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.798 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.3 Cg_endo -59.16 134.52 59.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.622 2.215 . . . . 1.0 112.69 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.993 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.556 -0.293 . . . . 1.0 110.598 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.754 0.312 . . . . 1.0 111.282 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.754 HG22 ' HD2' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -70.34 147.66 95.25 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.721 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.754 ' HD2' HG22 ' A' ' 4' ' ' ILE . 1.7 Cg_endo -79.83 119.6 4.04 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.563 2.175 . . . . 1.0 111.461 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.89 145.23 46.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.896 0.379 . . . . 1.0 111.009 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 9.4 m95 59.7 49.21 8.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.997 -0.547 . . . . 1.0 111.501 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.713 ' O ' HG13 ' A' ' 32' ' ' VAL . 2.8 mmtp -141.89 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.868 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.48 145.36 1.34 Allowed Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.005 -0.543 . . . . 1.0 113.191 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -95.66 0.76 53.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.386 0.143 . . . . 1.0 111.386 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.511 HG22 ' CE2' ' A' ' 30' ' ' PHE . 21.7 t -53.58 86.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 120.977 0.418 . . . . 1.0 111.559 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.1 t-20 175.41 81.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.415 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 mmt-85 68.57 10.58 7.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.19 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 45.98 71.19 0.31 Allowed 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.899 0.381 . . . . 1.0 111.445 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 123.95 40.75 0.44 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.62 -0.8 . . . . 1.0 113.012 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -100.46 23.02 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.427 0.156 . . . . 1.0 110.931 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 29.8 m -47.25 151.83 0.66 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.642 -0.254 . . . . 1.0 110.889 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.41 ' N ' HG12 ' A' ' 4' ' ' ILE . 28.3 t -67.81 -97.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.15 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' HG3' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.87 -155.03 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.214 -0.291 . . . . 1.0 110.214 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.88 31.37 0.75 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.651 -0.785 . . . . 1.0 114.346 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.674 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -78.16 147.14 34.67 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 117.591 0.696 . . . . 1.0 110.603 179.358 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -102.85 150.82 23.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.0 t -91.19 112.41 24.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.0 m0 -105.68 163.66 12.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.988 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.7 ptmt -116.68 151.71 35.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.911 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.41 126.09 53.08 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.591 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -38.67 4.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.946 -0.57 . . . . 1.0 111.074 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.78 -68.11 0.83 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.902 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.58 176.19 3.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.511 ' CE2' HG22 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.25 -152.67 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.913 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.405 ' C ' HG23 ' A' ' 32' ' ' VAL . 37.1 mt-10 -95.56 160.35 14.55 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 120.664 0.268 . . . . 1.0 110.687 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.713 HG13 ' O ' ' A' ' 8' ' ' LYS . 99.8 t -155.93 140.33 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.461 -0.336 . . . . 1.0 111.278 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 20.3 m -75.05 139.01 42.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.257 -0.429 . . . . 1.0 110.513 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 34' ' ' VAL . 29.0 m -128.29 120.92 21.28 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-O 120.491 0.186 . . . . 1.0 111.284 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HB3' HD23 ' A' ' 21' ' ' LEU . 36.6 Cg_endo -61.34 141.86 94.02 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.04 2.494 . . . . 1.0 112.325 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -48.73 -76.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 37' ' ' THR . 5.6 t . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.889 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.617 0.246 . . . . 1.0 111.224 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.767 HG21 ' HA ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -70.11 125.13 91.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.529 -0.305 . . . . 1.0 111.255 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.13 124.39 14.29 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.492 2.128 . . . . 1.0 112.119 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.465 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.88 -170.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.03 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.465 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 31.5 p-90 43.09 47.6 5.19 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.301 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.404 ' CD ' ' C ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -134.13 158.55 43.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.584 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.15 143.61 28.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.686 -0.769 . . . . 1.0 112.255 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 2.2 p -116.14 34.39 5.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.799 0.333 . . . . 1.0 111.31 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.56 128.23 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.329 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 59.5 18.92 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.279 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 mmm180 -149.66 66.2 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.256 0.55 . . . . 1.0 110.801 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.73 50.32 0.83 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.674 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 171.66 33.01 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.783 -0.723 . . . . 1.0 113.045 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.42 4.45 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.517 0.199 . . . . 1.0 110.628 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.767 ' HA ' HG21 ' A' ' 4' ' ' ILE . 86.6 m -70.34 148.52 48.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.788 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.446 ' N ' HG22 ' A' ' 4' ' ' ILE . 12.5 t -69.96 -93.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.366 -0.379 . . . . 1.0 110.897 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.41 -159.6 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.6 0.238 . . . . 1.0 110.747 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.29 41.38 2.46 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.587 -0.816 . . . . 1.0 112.751 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.573 HD23 ' CA ' ' A' ' 35' ' ' PRO . 1.2 mp -69.84 164.84 22.81 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 120.972 0.415 . . . . 1.0 111.389 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.544 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.7 OUTLIER -135.24 134.01 39.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.661 179.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.18 107.36 9.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.942 0.401 . . . . 1.0 110.82 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -93.45 126.12 38.42 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.292 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -74.17 136.98 42.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.467 . . . . 1.0 110.812 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -91.21 -162.97 0.97 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.584 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -70.03 -66.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 1.0 110.904 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.21 -52.37 2.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.79 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.88 171.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.962 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -68.6 -157.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.761 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 5.4 pt-20 -102.3 138.41 39.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 1.0 110.909 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.1 m -109.6 135.17 49.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.113 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 21' ' ' LEU . 14.2 t -59.72 135.85 57.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.093 -0.503 . . . . 1.0 111.414 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' GLU . 12.4 p -143.05 132.91 11.97 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-O 120.715 0.293 . . . . 1.0 111.363 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.573 ' CA ' HD23 ' A' ' 21' ' ' LEU . 32.6 Cg_endo -59.97 140.14 91.34 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.922 2.414 . . . . 1.0 112.576 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -66.37 -47.04 74.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.988 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.89 -0.595 . . . . 1.0 110.939 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.72 0.295 . . . . 1.0 111.061 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.415 ' CD1' ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -70.05 147.37 95.69 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 1.0 111.216 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 19.2 Cg_exo -64.11 130.7 28.05 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.622 2.215 . . . . 1.0 111.955 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.17 149.86 27.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 1.0 110.661 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.4 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 0.2 OUTLIER 63.11 36.42 12.22 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.836 -179.588 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -101.19 149.95 23.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.477 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.519 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -45.58 173.83 0.01 OUTLIER Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.3 -0.476 . . . . 1.0 113.531 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.427 ' O ' ' N ' ' A' ' 12' ' ' ASN . 19.3 t -104.45 -12.63 16.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.585 0.231 . . . . 1.0 111.424 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.97 82.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.993 0.425 . . . . 1.0 111.206 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 10' ' ' CYS . 6.0 t-20 177.46 75.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.473 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.412 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.0 OUTLIER 65.51 14.99 9.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.421 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 48.28 84.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.786 0.327 . . . . 1.0 111.334 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 109.37 53.31 0.6 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.58 -0.819 . . . . 1.0 112.517 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -111.43 20.73 16.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.562 0.22 . . . . 1.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' ' CD1' ' A' ' 4' ' ' ILE . 4.2 m -61.9 163.71 7.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.514 -0.312 . . . . 1.0 110.444 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.6 t -55.35 -94.71 0.0 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.77 -0.195 . . . . 1.0 110.798 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -66.64 -154.94 0.01 OUTLIER 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.1 -0.333 . . . . 1.0 110.1 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.49 33.27 1.59 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 1.0 113.001 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.814 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -69.71 151.47 45.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.93 0.365 . . . . 1.0 111.138 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.739 ' O ' HG12 ' A' ' 34' ' ' VAL . 1.5 pm0 -118.67 134.48 55.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.165 0.507 . . . . 1.0 110.291 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 14.6 p -79.1 126.9 31.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 33.0 m0 -108.78 135.99 49.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.011 -0.54 . . . . 1.0 111.203 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.5 tptm -90.1 134.65 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.458 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 174.93 5.67 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.084 0.468 . . . . 1.0 110.673 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -73.05 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.804 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -71.01 -66.98 0.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.548 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 p -69.28 152.14 45.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.213 -0.448 . . . . 1.0 110.714 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -147.11 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.731 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 8.5 mt-10 -89.92 169.44 11.23 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.841 0.353 . . . . 1.0 110.756 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.71 139.9 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 33.8 m -69.97 140.37 52.97 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.176 -0.466 . . . . 1.0 111.059 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 22' ' ' GLU . 7.2 p -143.2 138.24 15.48 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.674 -0.239 . . . . 1.0 111.095 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.814 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.3 Cg_endo -58.16 139.92 92.28 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.927 2.418 . . . . 1.0 112.747 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -51.18 -39.05 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 1.0 110.974 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.535 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 8.8 t . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 115.901 -0.591 . . . . 1.0 110.719 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 2.4 m . . . . . 0 CA--C 1.53 0.187 0 N-CA-C 110.702 -0.111 . . . . 1.0 110.702 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 17' ' ' CYS . 11.0 tt -70.63 140.98 87.22 Favored Pre-proline 0 N--CA 1.455 -0.183 0 O-C-N 122.393 -0.192 . . . . 1.0 110.798 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 44.3 Cg_exo -54.19 113.18 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.085 1.857 . . . . 1.0 111.828 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.23 145.67 46.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.875 0.369 . . . . 1.0 110.806 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.8 m0 67.68 19.35 9.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.805 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.535 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -110.23 173.8 6.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.729 0.299 . . . . 1.0 110.806 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.3 150.94 28.68 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.836 -0.697 . . . . 1.0 112.63 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 12' ' ' ASN . 21.0 p -115.1 19.06 15.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.475 0.179 . . . . 1.0 111.311 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.47 82.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.85 0.357 . . . . 1.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 10' ' ' CYS . 4.6 t-20 177.59 81.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.568 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 73.84 5.47 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.742 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.23 83.63 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 120.888 0.375 . . . . 1.0 111.33 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.08 34.41 0.89 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.596 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.64 22.03 13.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.664 0.269 . . . . 1.0 110.858 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.478 ' HA ' HG21 ' A' ' 4' ' ' ILE . 11.6 m -58.41 165.59 2.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 1.0 110.674 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 39.5 t -70.24 -88.57 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.387 -0.369 . . . . 1.0 111.915 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -67.88 66.47 0.1 Allowed 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.879 0.371 . . . . 1.0 111.702 -178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 39.97 26.64 0.1 Allowed Glycine 0 C--O 1.225 -0.433 0 C-N-CA 121.228 -0.511 . . . . 1.0 113.817 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.27 151.16 46.6 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 120.983 0.42 . . . . 1.0 110.576 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -101.54 159.03 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 1.0 110.774 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.8 t -98.51 120.25 38.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.921 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.592 ' CD2' HG11 ' A' ' 34' ' ' VAL . 30.7 m0 -109.69 130.98 55.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.69 148.29 25.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.7 mmt-85 -114.03 129.51 56.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.643 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.13 -30.39 1.12 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.448 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 -82.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.63 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.6 p -70.14 -177.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.915 0.388 . . . . 1.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -153.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.662 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -113.32 136.83 52.33 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.806 0.336 . . . . 1.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.535 HG12 ' C ' ' A' ' 8' ' ' LYS . 9.7 m -126.04 163.99 26.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.302 -0.408 . . . . 1.0 111.374 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.3 m -69.23 161.07 29.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.738 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.592 HG11 ' CD2' ' A' ' 24' ' ' TRP . 8.9 p -170.33 138.16 1.36 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.382 -0.372 . . . . 1.0 110.938 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HD2' HG23 ' A' ' 34' ' ' VAL . 18.5 Cg_endo -53.85 136.04 64.8 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.004 2.469 . . . . 1.0 112.554 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -89.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.326 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.188 0 O-C-N 122.397 -0.19 . . . . 1.0 110.926 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.597 0.237 . . . . 1.0 110.776 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 17' ' ' CYS . 2.1 pp -70.1 141.76 89.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.229 . . . . 1.0 111.207 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -68.45 140.24 47.43 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.534 2.156 . . . . 1.0 111.95 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -71.72 162.95 28.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 24.3 m0 60.14 31.48 20.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.024 -0.535 . . . . 1.0 111.271 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -120.06 147.72 44.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.517 179.867 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.666 ' CA ' HG12 ' A' ' 32' ' ' VAL . . . -71.07 136.68 25.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.059 -0.591 . . . . 1.0 112.845 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -94.32 27.45 2.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.689 0.281 . . . . 1.0 111.009 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.1 p -67.6 70.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 1.0 110.987 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -177.22 -70.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.455 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 7.5 mmm180 -95.84 -9.49 31.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.342 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 53.63 92.41 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-O 121.087 0.47 . . . . 1.0 110.832 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.72 48.81 4.81 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.238 -179.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.464 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 0.0 OUTLIER -88.08 5.27 41.9 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.515 -0.342 . . . . 1.0 111.204 -179.113 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 21' ' ' LEU . 57.3 m -45.69 138.8 4.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.946 0.403 . . . . 1.0 111.779 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 t -70.4 -83.31 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.377 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' H ' HD11 ' A' ' 21' ' ' LEU . 14.2 mt-10 -63.79 -153.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.608 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 17.98 3.34 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.625 -0.797 . . . . 1.0 113.173 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.535 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.69 144.3 52.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.098 0.449 . . . . 1.0 110.525 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -116.07 160.01 20.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 1.0 110.928 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -91.61 109.71 21.02 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.85 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 36.9 m0 -115.64 149.54 38.16 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.29 -0.413 . . . . 1.0 111.291 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -70.7 128.4 35.94 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.006 -0.543 . . . . 1.0 110.93 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.529 ' HD2' HG21 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.88 -162.61 0.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.563 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -68.12 0.44 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.794 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 ttp-105 -103.89 -43.08 5.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.9 p -67.73 157.37 34.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.996 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -158.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.433 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 44.0 mt-10 -80.26 124.56 28.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 120.978 0.418 . . . . 1.0 110.887 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.666 HG12 ' CA ' ' A' ' 9' ' ' GLY . 34.7 m -117.3 160.99 16.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 1.0 111.048 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 5.0 m -69.51 142.41 53.69 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.284 -0.416 . . . . 1.0 111.131 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 22' ' ' GLU . 13.0 p -142.34 120.16 7.37 Favored Pre-proline 0 C--N 1.323 -0.557 0 C-N-CA 122.195 0.198 . . . . 1.0 111.073 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.6 Cg_endo -57.94 139.08 89.13 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.858 2.372 . . . . 1.0 112.475 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.94 -35.83 2.18 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.116 -0.493 . . . . 1.0 111.137 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.8 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.639 179.876 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.571 0.224 . . . . 1.0 111.077 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.03 142.33 90.29 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.188 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.17 124.88 15.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.512 2.141 . . . . 1.0 111.983 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -70.16 150.38 46.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 7' ' ' TRP . 2.0 m0 67.33 27.27 8.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 1.0 111.184 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.04 169.05 9.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.426 -0.352 . . . . 1.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 152.15 46.48 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.662 -0.78 . . . . 1.0 112.569 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.91 5.48 49.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.407 0.151 . . . . 1.0 111.407 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.5 p -70.93 65.41 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.085 0.469 . . . . 1.0 110.861 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -177.32 -54.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.871 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.427 ' HB3' ' CB ' ' A' ' 16' ' ' ASP . 1.0 OUTLIER -97.91 -38.28 9.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.814 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.26 84.88 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.049 -0.523 . . . . 1.0 111.448 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.13 -0.88 71.86 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.742 -0.742 . . . . 1.0 113.259 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.427 ' CB ' ' HB3' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -98.14 24.13 7.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.985 0.421 . . . . 1.0 110.65 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 172.63 0.03 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.035 -0.53 . . . . 1.0 111.052 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.6 t -64.62 -96.7 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.533 -0.303 . . . . 1.0 111.164 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 21' ' ' LEU . 3.2 mm-40 -65.78 -164.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 N-CA-C 110.202 -0.296 . . . . 1.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.28 39.53 0.86 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.646 -0.788 . . . . 1.0 112.779 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.4 OUTLIER -69.82 155.14 40.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 120.819 0.343 . . . . 1.0 111.157 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.524 ' OE1' HG23 ' A' ' 34' ' ' VAL . 0.2 OUTLIER -127.98 135.81 50.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.598 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.5 m -74.78 127.59 33.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.009 -0.541 . . . . 1.0 111.134 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.468 ' CD2' HG21 ' A' ' 34' ' ' VAL . 18.9 m0 -119.28 133.95 55.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.877 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -83.14 148.07 27.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.768 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.835 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -76.16 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.133 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.44 -59.45 2.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.464 . . . . 1.0 110.923 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.58 162.25 3.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.736 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -82.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.792 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -159.53 144.38 15.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 1.0 111.073 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.9 m -125.94 143.23 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.287 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 148.92 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.249 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.524 HG23 ' OE1' ' A' ' 22' ' ' GLU . 2.2 m -147.46 132.87 9.21 Favored Pre-proline 0 C--N 1.323 -0.562 0 C-N-CA 122.401 0.281 . . . . 1.0 111.245 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -57.27 136.37 75.9 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.875 2.383 . . . . 1.0 112.685 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -68.96 -45.7 70.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.02 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 37' ' ' THR . 10.1 t . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.446 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.522 -0.118 0 CA-C-O 120.768 0.318 . . . . 1.0 111.307 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.576 HG23 ' O ' ' A' ' 4' ' ' ILE . 8.0 tp -70.18 116.38 43.99 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 111.291 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.48 117.59 4.33 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.391 2.061 . . . . 1.0 111.885 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.62 169.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.18 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 25.4 m95 61.82 38.15 14.97 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.075 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.25 164.34 30.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.78 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.73 136.22 47.71 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.757 -0.735 . . . . 1.0 112.539 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.4 p -117.36 21.83 12.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.654 0.264 . . . . 1.0 111.275 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -59.05 87.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.901 0.381 . . . . 1.0 111.101 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -176.84 78.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 70.75 5.18 5.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.83 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 44.24 83.04 0.03 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.015 0.436 . . . . 1.0 111.412 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.25 10.29 1.96 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.67 -0.776 . . . . 1.0 113.143 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.89 11.84 23.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.226 0.513 . . . . 1.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' HG21 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -57.76 179.63 0.06 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 1.0 110.891 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.8 t -68.99 -95.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.692 -0.231 . . . . 1.0 111.036 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 -155.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.212 -0.292 . . . . 1.0 110.212 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.76 34.71 2.31 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.725 -0.75 . . . . 1.0 112.784 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.759 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.48 152.77 44.46 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 120.781 0.324 . . . . 1.0 111.023 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.3 pt-20 -116.85 158.39 24.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.917 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.0 m -86.69 113.85 22.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.902 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.797 ' CD2' HG11 ' A' ' 34' ' ' VAL . 18.8 m0 -108.4 136.4 48.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.822 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -88.18 150.85 23.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.037 0.446 . . . . 1.0 110.948 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -110.39 122.58 48.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.679 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -46.31 -40.5 11.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.275 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -92.51 -75.94 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -176.11 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.153 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -149.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 1.0 110.728 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.33 176.1 7.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.764 0.316 . . . . 1.0 110.677 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -170.11 144.81 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.451 -0.341 . . . . 1.0 111.388 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 153.63 40.03 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.96 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.797 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.1 p -146.53 137.23 12.48 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 116.727 -0.215 . . . . 1.0 111.547 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.759 ' HA ' HD23 ' A' ' 21' ' ' LEU . 36.8 Cg_endo -61.36 145.79 97.91 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.953 2.435 . . . . 1.0 112.464 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -131.54 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.331 -0.395 . . . . 1.0 110.48 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 68.5 m . . . . . 0 C--N 1.332 -0.187 0 CA-C-O 120.614 0.245 . . . . 1.0 110.878 179.894 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.454 -0.266 0 CA-C-O 120.619 0.247 . . . . 1.0 111.178 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.561 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.6 pp -58.15 161.23 7.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.515 -0.311 . . . . 1.0 111.375 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -81.97 112.16 2.29 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.019 2.479 . . . . 1.0 111.774 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 pttt -58.3 155.48 11.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.918 0.389 . . . . 1.0 111.163 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.4 m95 60.38 43.38 13.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.349 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' C ' HG12 ' A' ' 32' ' ' VAL . 4.6 mmtp -142.6 170.16 16.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.94 162.85 6.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.77 -0.729 . . . . 1.0 112.607 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.407 ' O ' ' N ' ' A' ' 12' ' ' ASN . 3.2 m -127.03 19.23 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.426 0.155 . . . . 1.0 111.302 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 t -57.42 85.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.78 0.324 . . . . 1.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 10' ' ' CYS . 30.4 t-20 179.76 80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 1.0 110.526 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 68.28 13.59 9.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.264 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.94 37.1 4.55 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.406 -0.361 . . . . 1.0 111.455 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 174.15 37.23 0.04 OUTLIER Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.999 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.8 15.04 29.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.531 0.205 . . . . 1.0 110.962 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.12 174.86 4.99 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.587 -0.278 . . . . 1.0 110.655 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.402 ' HB3' HD11 ' A' ' 21' ' ' LEU . 51.3 t -70.03 -105.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.753 -0.203 . . . . 1.0 111.045 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.43 ' N ' HD11 ' A' ' 21' ' ' LEU . 6.4 mm-40 -60.23 -161.47 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.163 -0.31 . . . . 1.0 110.163 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.48 39.41 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.413 -0.899 . . . . 1.0 112.87 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.661 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -70.01 147.95 49.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.823 0.344 . . . . 1.0 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.3 OUTLIER -117.03 153.56 32.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.003 0.43 . . . . 1.0 110.647 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.19 114.37 26.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.282 -0.417 . . . . 1.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -103.47 129.8 50.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.075 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -84.64 134.66 34.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.704 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -163.55 0.85 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.353 . . . . 1.0 110.641 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -79.7 0.06 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.636 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.47 -39.25 10.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.593 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.97 167.99 4.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.846 -0.616 . . . . 1.0 111.024 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -156.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -107.35 155.08 20.39 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.828 0.346 . . . . 1.0 110.721 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.426 HG12 ' C ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -141.18 138.57 33.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.315 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.65 155.26 16.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.609 HG12 ' O ' ' A' ' 22' ' ' GLU . 5.9 p -155.28 116.72 2.36 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.024 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.661 ' HB3' HD23 ' A' ' 21' ' ' LEU . 30.7 Cg_endo -60.0 137.76 77.89 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.764 2.309 . . . . 1.0 112.596 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.2 -67.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.907 -0.588 . . . . 1.0 111.436 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.543 -0.298 . . . . 1.0 111.075 179.994 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 120.603 0.24 . . . . 1.0 111.433 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.441 HD12 ' O ' ' A' ' 5' ' ' PRO . 2.5 pp -70.1 144.7 93.0 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.402 -0.363 . . . . 1.0 111.287 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.441 ' O ' HD12 ' A' ' 4' ' ' ILE . 41.9 Cg_exo -55.11 140.71 80.65 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.382 2.055 . . . . 1.0 112.052 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 18.0 pttt -96.02 30.81 2.3 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.996 0.427 . . . . 1.0 111.198 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 8.6 m95 -148.21 29.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.754 -0.657 . . . . 1.0 110.737 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.753 ' O ' HG23 ' A' ' 32' ' ' VAL . 27.9 mmtm -118.68 161.69 19.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.385 . . . . 1.0 110.999 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 31' ' ' GLU . . . -54.71 -179.16 0.18 Allowed Glycine 0 C--N 1.329 0.163 0 C-N-CA 121.053 -0.594 . . . . 1.0 112.434 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 31' ' ' GLU . 1.6 t -131.86 11.03 4.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 111.607 0.225 . . . . 1.0 111.607 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 11' ' ' VAL . 13.0 p -77.32 55.07 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.949 0.404 . . . . 1.0 111.092 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 51.5 t-20 172.96 -36.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.111 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mmt-85 -81.46 -52.18 7.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.779 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 51.43 67.05 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.121 0.486 . . . . 1.0 110.937 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.55 26.08 66.3 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.813 -0.708 . . . . 1.0 112.271 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.77 23.43 11.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.619 0.247 . . . . 1.0 110.919 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 4' ' ' ILE . 3.5 m -58.65 167.56 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 1.0 110.388 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -60.31 -85.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.531 -179.775 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.432 ' N ' ' SG ' ' A' ' 18' ' ' CYS . 22.9 mt-10 -70.34 -161.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.06 37.76 1.32 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.373 -0.918 . . . . 1.0 112.342 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.0 154.2 42.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.069 0.461 . . . . 1.0 110.95 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.575 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -109.72 149.86 29.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.315 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.25 98.74 9.97 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 1.0 110.537 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.656 ' CD2' HG11 ' A' ' 34' ' ' VAL . 42.6 m0 -76.74 133.55 39.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 1.0 111.131 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -84.56 165.82 17.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.777 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 148.79 35.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.696 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -56.12 -54.57 43.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.995 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 mtp85 -70.32 -80.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 1.0 110.624 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 p -70.12 163.04 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.765 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -80.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.419 ' O ' ' HA2' ' A' ' 9' ' ' GLY . 18.2 mt-10 -154.82 -167.97 2.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.743 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.753 HG23 ' O ' ' A' ' 8' ' ' LYS . 7.3 p -170.28 142.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 1.0 111.027 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.8 m -67.01 159.99 27.47 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.502 -0.317 . . . . 1.0 110.621 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.656 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.7 p -173.18 137.55 0.77 Allowed Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 111.613 0.227 . . . . 1.0 111.613 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.815 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.2 Cg_endo -59.01 140.86 97.23 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.955 2.437 . . . . 1.0 112.418 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -60.34 -78.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 80.0 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.347 -0.388 . . . . 1.0 110.792 179.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.71 0.29 . . . . 1.0 110.756 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.847 HD11 ' HG3' ' A' ' 8' ' ' LYS . 0.5 OUTLIER -70.14 117.6 55.85 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.081 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.8 171.78 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.633 2.222 . . . . 1.0 112.852 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 35' ' ' PRO . 34.0 pttt -87.39 50.45 2.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.927 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.454 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.0 m95 -147.99 29.32 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.433 -0.349 . . . . 1.0 111.1 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.847 ' HG3' HD11 ' A' ' 4' ' ' ILE . 9.6 tmtm? -116.69 137.98 51.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.27 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.412 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -50.18 144.87 9.93 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.997 -0.62 . . . . 1.0 112.671 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 p -109.99 7.34 23.67 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.755 0.28 . . . . 1.0 111.755 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.592 HG22 ' OE2' ' A' ' 31' ' ' GLU . 34.8 t -61.95 138.22 22.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.538 0.209 . . . . 1.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.1 t-20 68.88 84.53 0.15 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.207 0.527 . . . . 1.0 109.629 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 1.2 mmm180 76.39 82.32 0.09 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.075 -0.966 . . . . 1.0 109.845 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -67.48 49.74 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.986 -1.006 . . . . 1.0 111.897 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -160.66 22.26 0.24 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 121.169 -0.539 . . . . 1.0 112.356 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -6.86 59.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.616 0.246 . . . . 1.0 110.982 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.836 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.9 t -69.73 -159.81 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.788 -0.449 . . . . 1.0 109.788 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.469 ' N ' ' CG2' ' A' ' 4' ' ' ILE . 42.3 t -70.31 -105.29 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.15 0.426 . . . . 1.0 112.15 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.637 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -70.43 -160.46 0.04 OUTLIER 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.566 0.222 . . . . 1.0 110.851 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.18 47.67 2.66 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.313 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.836 HD13 ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -69.4 144.15 53.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.915 0.388 . . . . 1.0 110.763 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.5 165.68 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.232 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.27 107.2 17.7 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.851 -0.613 . . . . 1.0 110.571 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -102.22 126.97 49.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.83 145.05 29.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.619 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -107.02 123.08 47.68 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -46.31 -29.88 1.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.025 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.57 -70.99 0.73 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.74 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.8 p -70.15 179.59 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.954 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.96 -155.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.967 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' HG22 ' A' ' 11' ' ' VAL . 7.9 mt-10 -99.24 -178.47 3.93 Favored 'General case' 0 N--CA 1.458 -0.071 0 CA-C-N 116.614 -0.267 . . . . 1.0 110.535 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.481 HG22 ' N ' ' A' ' 33' ' ' CYS . 4.8 p -170.21 157.39 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.811 0.339 . . . . 1.0 111.82 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.481 ' N ' HG22 ' A' ' 32' ' ' VAL . 4.5 p -99.54 117.63 34.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.789 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 34' ' ' VAL . 13.5 p -109.32 117.27 53.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.68 -0.236 . . . . 1.0 111.61 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.777 ' HB3' HD23 ' A' ' 21' ' ' LEU . 29.1 Cg_endo -59.79 132.08 43.32 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.843 2.362 . . . . 1.0 113.14 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -70.71 -47.18 61.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.598 -0.728 . . . . 1.0 110.654 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.9 t . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.959 -0.564 . . . . 1.0 110.998 -179.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.522 -0.11 0 CA-C-O 120.66 0.267 . . . . 1.0 111.061 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 5' ' ' PRO . 1.8 pp -69.96 140.55 88.72 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.265 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.424 ' O ' HD12 ' A' ' 4' ' ' ILE . 23.7 Cg_exo -62.2 149.96 88.62 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.391 2.06 . . . . 1.0 112.03 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.489 ' HB3' ' CD1' ' A' ' 7' ' ' TRP . 17.4 mtmm -60.53 165.69 3.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 1.0 110.955 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 46.91 69.98 0.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.067 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' GLY . 4.4 tmtm? -129.46 132.15 46.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.839 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.414 ' N ' ' HD3' ' A' ' 8' ' ' LYS . . . -48.94 139.74 12.58 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 121.235 -0.507 . . . . 1.0 112.811 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.8 p -106.04 -3.22 21.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.511 0.196 . . . . 1.0 111.396 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.6 t -83.25 64.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.827 0.346 . . . . 1.0 111.373 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.41 ' N ' ' OD1' ' A' ' 12' ' ' ASN . 1.4 p30 -153.89 -86.87 0.06 Allowed 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.855 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 -88.15 -11.89 45.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.597 0.237 . . . . 1.0 111.32 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 53.81 79.22 0.13 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.0 0.429 . . . . 1.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.67 6.82 6.45 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.818 -0.705 . . . . 1.0 112.743 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -69.89 -13.98 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.991 0.395 . . . . 1.0 111.034 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.45 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 84.8 m -59.23 142.49 51.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.589 -0.278 . . . . 1.0 110.501 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.427 ' HB3' HD11 ' A' ' 21' ' ' LEU . 46.4 t -56.98 -103.36 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.428 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.456 ' N ' HD11 ' A' ' 21' ' ' LEU . 17.0 mm-40 -63.97 -157.19 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.079 -0.341 . . . . 1.0 110.079 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.82 42.4 2.04 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.521 -0.847 . . . . 1.0 112.935 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.684 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -71.68 148.67 46.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.8 0.333 . . . . 1.0 110.894 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -123.84 148.85 46.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.186 0.517 . . . . 1.0 110.856 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 6.8 p -90.79 119.07 30.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.089 -0.505 . . . . 1.0 111.47 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' OE1' ' A' ' 22' ' ' GLU . 35.8 m0 -101.09 125.67 47.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.716 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -73.78 136.51 43.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 1.0 110.475 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.99 -168.45 1.46 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.331 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -46.92 87.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.622 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.71 -42.3 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.636 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.3 t -59.07 173.03 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.011 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.726 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.5 OUTLIER -61.95 -167.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.366 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.26 146.24 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.457 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' HA ' ' A' ' 7' ' ' TRP . 3.9 m -128.36 137.64 56.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.953 0.406 . . . . 1.0 111.377 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -61.77 146.49 49.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.145 -0.479 . . . . 1.0 111.521 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 22' ' ' GLU . 8.8 p -147.12 127.17 6.73 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.896 -0.593 . . . . 1.0 110.831 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.684 ' CA ' HD23 ' A' ' 21' ' ' LEU . 20.0 Cg_endo -56.91 131.12 43.58 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.877 2.385 . . . . 1.0 112.929 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 ptmm? -70.14 -100.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.728 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 84.5 m . . . . . 0 C--N 1.333 -0.144 0 CA-C-O 120.485 0.183 . . . . 1.0 110.667 179.646 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.655 0.264 . . . . 1.0 111.04 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.489 HD12 ' C ' ' A' ' 4' ' ' ILE . 1.4 pp -70.13 157.82 88.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.264 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.46 ' C ' HD12 ' A' ' 4' ' ' ILE . 5.1 Cg_exo -75.12 120.01 5.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.781 2.321 . . . . 1.0 111.928 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.44 ' C ' ' CG ' ' A' ' 7' ' ' TRP . 12.1 mttt -51.11 148.02 4.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 1.0 111.363 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.44 ' CG ' ' C ' ' A' ' 6' ' ' LYS . 0.7 OUTLIER 44.04 68.94 0.46 Allowed 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 115.859 -0.61 . . . . 1.0 111.98 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 5' ' ' PRO . 36.2 mmtt -148.28 173.81 12.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 1.0 110.831 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -48.31 152.46 2.34 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 121.034 -0.603 . . . . 1.0 112.771 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 31' ' ' GLU . 62.6 m -96.54 0.51 50.21 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.59 0.219 . . . . 1.0 111.59 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.3 p -49.79 89.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 120.936 0.398 . . . . 1.0 111.182 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.6 t-20 173.61 84.49 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 1.0 109.997 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.11 27.71 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 42.71 32.79 0.41 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.948 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.09 37.58 0.04 OUTLIER Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.131 -1.033 . . . . 1.0 113.195 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -107.41 14.75 25.62 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.679 0.276 . . . . 1.0 110.611 179.47 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' HD13 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -57.1 177.23 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.655 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.464 ' HB3' HD11 ' A' ' 21' ' ' LEU . 50.3 t -70.17 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.029 -0.268 . . . . 1.0 111.524 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.519 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.66 -152.25 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.614 0.245 . . . . 1.0 110.745 179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.96 37.38 2.52 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.707 -0.759 . . . . 1.0 112.788 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.1 OUTLIER -69.86 145.03 52.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.009 0.433 . . . . 1.0 110.726 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.887 ' HG2' HG23 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -91.7 159.44 15.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.702 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.58 114.46 27.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.864 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.5 m0 -99.28 101.17 12.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.87 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 140.27 36.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 1.0 110.762 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -105.27 117.33 33.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.484 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -45.93 -31.5 2.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.108 -0.496 . . . . 1.0 111.221 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mmt-85 -85.88 -86.62 0.14 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.631 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.0 t -70.39 -164.16 0.08 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.833 0.349 . . . . 1.0 110.856 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -154.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.484 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 10' ' ' CYS . 23.5 mt-10 -109.59 175.64 5.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.666 -0.243 . . . . 1.0 110.368 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.2 t -152.79 139.38 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 1.0 111.706 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 151.46 21.48 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.958 -0.565 . . . . 1.0 110.409 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.887 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 m -145.25 122.52 6.25 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 111.642 0.238 . . . . 1.0 111.642 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 21' ' ' LEU . 38.6 Cg_endo -61.96 142.09 91.7 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.24 2.627 . . . . 1.0 112.54 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.221 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.602 -0.272 . . . . 1.0 111.254 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.522 -0.102 0 CA-C-O 121.01 0.433 . . . . 1.0 111.159 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.51 HD12 ' H ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -69.71 172.07 6.11 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.446 ' CD ' ' HB ' ' A' ' 4' ' ' ILE . 13.3 Cg_exo -68.77 116.16 4.3 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.672 2.248 . . . . 1.0 111.851 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -88.99 39.81 0.95 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.268 -179.68 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 43.1 m95 -150.22 22.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.0 110.666 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 mmtm -115.6 158.5 22.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.028 0.442 . . . . 1.0 111.07 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.0 173.67 0.59 Allowed Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.792 -0.64 . . . . 1.0 113.092 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 t -106.55 -2.76 21.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.585 0.231 . . . . 1.0 111.514 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.562 HG13 ' O ' ' A' ' 11' ' ' VAL . 12.7 p -76.88 60.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.944 0.402 . . . . 1.0 111.254 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -178.64 -56.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 1.0 110.728 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -48.19 18.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.17 32.05 10.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.938 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 111.56 4.78 26.52 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.902 -0.666 . . . . 1.0 112.539 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -0.83 50.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.828 0.314 . . . . 1.0 111.312 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.986 ' HB3' HD13 ' A' ' 21' ' ' LEU . 64.0 m -53.35 170.57 0.09 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.682 -0.235 . . . . 1.0 110.761 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.917 ' SG ' HD11 ' A' ' 21' ' ' LEU . 21.8 p -63.43 -123.94 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 121.231 -0.188 . . . . 1.0 111.451 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 21' ' ' LEU . 1.1 mt-10 -46.77 91.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 112.866 0.691 . . . . 1.0 112.866 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' GLU . . . 18.15 45.61 0.01 OUTLIER Glycine 0 C--N 1.337 0.608 0 CA-C-N 114.962 -1.017 . . . . 1.0 115.452 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' A' ' 17' ' ' CYS . 3.0 mp -68.83 161.05 29.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 117.207 0.503 . . . . 1.0 110.894 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -132.89 133.74 43.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.428 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 8.1 p -84.51 115.56 22.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.08 0.467 . . . . 1.0 111.127 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.456 ' CD2' HG21 ' A' ' 34' ' ' VAL . 52.0 m0 -90.19 134.21 34.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.591 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 142.86 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.955 0.407 . . . . 1.0 110.956 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -115.66 135.43 54.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 1.0 110.464 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.98 -50.43 19.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.672 -0.694 . . . . 1.0 111.433 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -89.04 -71.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.19 173.99 6.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.751 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -146.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.516 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -107.63 131.47 54.35 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 110.447 -0.205 . . . . 1.0 110.447 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 23.4 m -115.41 138.57 45.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.632 0.254 . . . . 1.0 111.625 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -66.01 147.12 53.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.545 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.456 HG21 ' CD2' ' A' ' 24' ' ' TRP . 2.4 m -149.92 125.13 4.84 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.704 ' N ' HD23 ' A' ' 21' ' ' LEU . 17.8 Cg_endo -56.61 132.79 53.9 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.768 2.312 . . . . 1.0 112.943 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -70.26 -111.31 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.761 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 37' ' ' THR . 10.0 t . . . . . 0 CA--C 1.531 0.232 0 O-C-N 122.297 -0.252 . . . . 1.0 111.028 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 120.541 0.21 . . . . 1.0 111.198 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.4 pp -63.73 140.38 97.8 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.635 -0.257 . . . . 1.0 111.186 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.0 148.15 93.65 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.528 2.152 . . . . 1.0 112.303 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -95.19 38.51 1.13 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.885 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -156.86 27.99 0.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.701 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.697 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -120.14 166.54 13.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.033 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.49 35.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.725 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.96 26.73 8.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.709 0.29 . . . . 1.0 110.979 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE2' ' A' ' 30' ' ' PHE . 22.0 t -100.6 71.88 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.142 0.496 . . . . 1.0 111.091 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -176.83 -62.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 1.0 110.613 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.68 -46.3 22.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 55.7 87.2 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.05 -12.8 9.77 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.386 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -11.67 61.07 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.642 0.258 . . . . 1.0 111.185 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.3 m -48.44 144.83 3.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.708 -0.224 . . . . 1.0 110.55 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.3 t -59.61 -102.6 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.218 -0.193 . . . . 1.0 111.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.3 -157.59 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 N-CA-C 110.291 -0.263 . . . . 1.0 110.291 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.17 43.12 2.44 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.508 -0.854 . . . . 1.0 112.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.456 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.71 148.72 48.87 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 120.972 0.415 . . . . 1.0 111.216 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -111.76 151.05 29.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 1.0 111.29 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.2 m -78.17 120.21 22.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.673 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.419 ' CD2' HG11 ' A' ' 34' ' ' VAL . 6.9 m0 -119.02 139.37 51.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.863 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -81.67 147.39 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.963 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -120.02 138.81 53.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.104 0.478 . . . . 1.0 110.543 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.12 -57.93 7.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 1.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -71.91 0.42 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.724 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.99 170.3 8.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.845 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.711 ' CE2' HG21 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.24 -145.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.112 -0.495 . . . . 1.0 110.935 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -97.21 126.63 42.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.781 0.324 . . . . 1.0 110.769 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.697 HG12 ' C ' ' A' ' 8' ' ' LYS . 27.6 m -124.15 152.21 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 116.343 -0.389 . . . . 1.0 111.563 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.19 149.05 37.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.215 -0.448 . . . . 1.0 111.173 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.451 HG23 ' HD2' ' A' ' 35' ' ' PRO . 10.8 p -148.58 137.34 11.86 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.527 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.451 ' HD2' HG23 ' A' ' 34' ' ' VAL . 20.9 Cg_endo -56.58 138.27 84.04 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.954 2.436 . . . . 1.0 112.484 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -102.76 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.135 -0.484 . . . . 1.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.494 0.188 . . . . 1.0 111.126 -179.898 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 18' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.674 0.273 . . . . 1.0 110.745 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.471 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.1 pt -60.0 157.48 30.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.503 -0.317 . . . . 1.0 110.648 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.441 ' HB2' ' CE ' ' A' ' 8' ' ' LYS . 52.5 Cg_exo -53.46 96.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 122.385 2.057 . . . . 1.0 112.002 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.76 151.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.29 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.428 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 38.6 m0 63.4 49.88 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.231 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 32' ' ' VAL . 1.5 tptp -117.04 152.76 33.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 1.0 110.809 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.43 158.23 23.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.681 -0.771 . . . . 1.0 112.22 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -3.49 45.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.528 0.204 . . . . 1.0 111.325 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.3 p -69.02 69.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.908 0.385 . . . . 1.0 110.843 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.424 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.6 t-20 -177.97 80.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.054 -0.521 . . . . 1.0 110.506 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.8 OUTLIER 68.22 12.12 8.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.572 . . . . 1.0 111.351 -179.784 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 42.34 79.43 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.859 0.361 . . . . 1.0 111.511 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.81 46.01 0.62 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -96.45 23.79 6.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.906 0.384 . . . . 1.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.724 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.2 m -70.11 144.56 52.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.403 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.734 ' SG ' HD11 ' A' ' 21' ' ' LEU . 1.6 p -55.71 -105.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.568 -0.287 . . . . 1.0 111.748 -179.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -57.28 -155.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.644 0.259 . . . . 1.0 110.812 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.411 ' H ' ' HB2' ' A' ' 19' ' ' GLU . . . -71.49 32.02 0.58 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.766 -0.731 . . . . 1.0 114.429 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.734 HD11 ' SG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -73.13 140.06 46.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.744 0.772 . . . . 1.0 110.186 179.143 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -108.66 162.89 13.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.906 0.384 . . . . 1.0 111.158 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.85 100.38 13.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.729 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 25.7 m0 -100.35 144.64 29.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.073 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.56 133.26 39.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.721 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.97 -172.25 2.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.012 0.434 . . . . 1.0 110.759 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -70.27 -71.52 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.811 -0.632 . . . . 1.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -70.88 -76.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.038 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -58.85 147.49 33.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 1.0 110.835 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.0 110.497 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.64 137.72 51.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.775 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 8' ' ' LYS . 11.2 p -132.8 145.27 34.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.373 -0.376 . . . . 1.0 111.268 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 53.4 m -61.8 137.27 58.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.961 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.52 126.93 7.62 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.801 -0.182 . . . . 1.0 111.348 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -59.53 141.85 97.96 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.92 2.413 . . . . 1.0 112.486 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -49.79 -62.68 1.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.041 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 75.5 m . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.686 179.857 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.233 0 CA-C-O 120.656 0.265 . . . . 1.0 110.748 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.6 pp -51.9 141.29 28.27 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 1.0 111.66 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -80.08 158.79 23.74 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.787 2.325 . . . . 1.0 111.862 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -62.04 161.5 10.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.952 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.443 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 42.6 m0 62.78 48.06 4.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.921 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -130.03 142.32 50.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.31 175.81 2.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 1.0 112.641 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.412 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 1.9 t -104.95 1.88 29.21 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.576 0.214 . . . . 1.0 111.576 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.0 p -67.39 68.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 CA-C-O 121.124 0.488 . . . . 1.0 111.11 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -169.95 76.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.591 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 75.61 7.17 3.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.245 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 49.04 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.317 . . . . 1.0 111.35 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.4 38.8 1.07 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.962 -0.637 . . . . 1.0 112.495 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.91 20.42 13.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.649 0.262 . . . . 1.0 111.252 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.477 ' HA ' HD11 ' A' ' 4' ' ' ILE . 58.4 m -55.39 147.3 17.54 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.561 0.219 . . . . 1.0 110.562 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 42.4 t -61.84 -96.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.617 -0.265 . . . . 1.0 110.939 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.504 ' H ' HD11 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -62.56 -154.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.028 -0.36 . . . . 1.0 110.028 179.392 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.47 33.43 1.59 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.594 -0.812 . . . . 1.0 112.896 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.504 HD11 ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.62 157.08 28.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.909 0.385 . . . . 1.0 111.042 -179.745 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 34' ' ' VAL . 1.9 pt-20 -132.2 126.24 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.347 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 13.2 p -69.48 109.69 4.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.084 0.469 . . . . 1.0 111.115 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.4 ' CE3' HG21 ' A' ' 34' ' ' VAL . 51.2 m0 -97.4 143.74 27.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.861 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -67.5 146.89 53.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 1.0 110.895 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -128.01 -177.75 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.575 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -78.51 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.898 -0.592 . . . . 1.0 111.229 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.39 -73.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.331 -0.395 . . . . 1.0 111.12 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -65.59 168.21 7.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.45 -0.341 . . . . 1.0 110.95 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -81.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.42 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.412 ' HG3' ' HB2' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -153.39 136.38 15.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.31 -0.404 . . . . 1.0 110.64 179.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.2 m -121.13 141.63 40.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.36 -0.382 . . . . 1.0 111.487 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 79.6 m -58.79 133.35 55.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.02 -0.537 . . . . 1.0 111.323 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 22' ' ' GLU . 5.2 m -137.66 133.32 17.83 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.028 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.2 136.94 75.55 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.971 2.448 . . . . 1.0 112.403 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -51.21 -47.05 62.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.8 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.87 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.737 0.303 . . . . 1.0 111.18 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 2.3 pp -70.3 143.34 90.69 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.4 -0.364 . . . . 1.0 111.258 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 3.0 Cg_exo -73.65 140.36 29.4 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.553 2.169 . . . . 1.0 111.661 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 1.0 OUTLIER -55.52 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.984 0.421 . . . . 1.0 111.103 -179.848 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.482 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 48.0 p-90 41.14 32.34 0.18 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.748 -0.66 . . . . 1.0 111.344 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.83 143.93 31.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 1.0 111.066 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.58 152.49 51.53 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.574 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.9 m -86.13 -4.74 59.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.641 0.258 . . . . 1.0 111.417 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.415 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.5 t -68.51 72.5 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.957 0.408 . . . . 1.0 110.953 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -176.23 78.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.974 -0.557 . . . . 1.0 110.826 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.46 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 0.9 OUTLIER 74.63 4.33 4.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.642 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 47.13 83.93 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.761 0.315 . . . . 1.0 111.247 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.49 38.21 0.6 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.662 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.443 ' O ' HG21 ' A' ' 4' ' ' ILE . 0.3 OUTLIER -98.97 10.11 42.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.507 0.194 . . . . 1.0 111.295 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HB3' HD13 ' A' ' 21' ' ' LEU . 10.0 m -65.9 152.24 44.93 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.656 -0.247 . . . . 1.0 110.534 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.441 ' HB3' HD11 ' A' ' 21' ' ' LEU . 35.4 t -59.22 -100.64 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.769 -0.196 . . . . 1.0 111.048 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -70.13 -161.65 0.05 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.467 0.175 . . . . 1.0 110.558 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.45 47.88 2.12 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.609 -0.805 . . . . 1.0 112.192 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.08 151.1 45.88 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.968 0.413 . . . . 1.0 111.069 -179.675 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.94 142.9 26.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.988 -0.551 . . . . 1.0 111.222 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 23.0 t -89.24 103.32 15.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.986 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -81.22 90.09 6.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.75 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.96 133.97 33.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.264 0.554 . . . . 1.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -99.12 117.9 34.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.947 -0.57 . . . . 1.0 110.649 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 -43.27 -31.91 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.369 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -59.14 1.99 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.353 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.06 -179.81 2.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.012 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.415 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -70.08 -166.74 0.13 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.009 179.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -113.14 160.25 18.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.589 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -160.05 131.42 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.582 -0.281 . . . . 1.0 111.207 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.48 149.33 28.79 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.397 -0.365 . . . . 1.0 111.127 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 35' ' ' PRO . 12.7 p -145.35 136.48 12.52 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 1.0 111.287 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.765 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.8 Cg_endo -58.87 138.63 86.78 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.201 2.601 . . . . 1.0 112.625 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -69.72 -40.01 76.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.159 -0.473 . . . . 1.0 111.076 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.45 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.4 m . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.145 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 4.1 m . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.404 0.145 . . . . 1.0 111.018 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.463 HD11 ' SG ' ' A' ' 17' ' ' CYS . 2.2 pp -70.52 158.13 88.47 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.273 . . . . 1.0 111.263 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -59.63 98.37 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.434 2.09 . . . . 1.0 111.646 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -46.33 134.49 8.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.003 0.43 . . . . 1.0 111.576 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 28.3 m0 64.29 75.68 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.173 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -156.5 174.55 15.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.61 179.55 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -55.31 132.13 49.04 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.847 -0.692 . . . . 1.0 112.791 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -98.61 23.64 8.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.623 0.249 . . . . 1.0 111.217 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' CD2' ' A' ' 30' ' ' PHE . 20.1 t -75.62 77.75 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.939 0.4 . . . . 1.0 110.972 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -176.9 78.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 73.6 5.32 4.9 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.211 -0.449 . . . . 1.0 111.691 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.98 34.52 2.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.629 0.252 . . . . 1.0 111.383 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 179.46 35.79 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.411 -0.9 . . . . 1.0 112.816 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.28 14.68 31.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 1.0 110.938 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.463 ' SG ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -70.08 167.62 17.28 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.464 -0.335 . . . . 1.0 111.036 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 42.0 t -67.47 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.236 -0.438 . . . . 1.0 111.45 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -155.12 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.56 0.219 . . . . 1.0 110.639 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.25 34.6 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.618 -0.801 . . . . 1.0 113.282 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.751 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.67 150.24 47.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.9 0.35 . . . . 1.0 110.671 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.445 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.0 pt-20 -126.3 144.27 50.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.066 0.46 . . . . 1.0 111.112 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.4 m -73.88 124.47 26.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.839 -0.619 . . . . 1.0 110.782 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.562 ' CD2' HG11 ' A' ' 34' ' ' VAL . 22.3 m0 -113.73 122.98 48.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.899 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -57.47 150.94 17.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.001 0.429 . . . . 1.0 110.92 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.07 141.53 48.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.547 . . . . 1.0 110.592 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -41.5 66.64 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 1.0 111.134 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.49 -81.97 0.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.785 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.83 -179.84 1.97 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.758 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -69.96 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.52 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 mp0 -140.82 140.25 34.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 1.0 110.753 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -122.98 129.12 75.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 1.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 149.49 40.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.221 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.5 p -147.45 123.59 5.46 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.441 -0.345 . . . . 1.0 111.364 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.751 ' CA ' HD23 ' A' ' 21' ' ' LEU . 29.0 Cg_endo -59.23 138.59 85.74 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.61 2.207 . . . . 1.0 112.651 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -30.2 70.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.892 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.2 m . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.97 -179.828 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.724 0.297 . . . . 1.0 110.861 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.544 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.5 pp -70.18 158.6 87.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.848 0.356 . . . . 1.0 110.946 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -61.12 93.76 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.476 2.117 . . . . 1.0 112.23 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -61.72 146.68 48.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.787 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 35.3 m95 61.69 38.48 15.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.075 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.765 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.8 mmtm -131.07 -176.14 3.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.879 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.49 -170.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.655 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.41 ' O ' ' ND1' ' A' ' 14' ' ' HIS . 1.6 m -115.06 -4.74 12.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 111.606 0.224 . . . . 1.0 111.606 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 18.9 t -68.2 63.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.848 0.356 . . . . 1.0 111.389 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 56.9 t-20 174.34 83.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.329 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 mmm180 70.38 76.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.307 0.575 . . . . 1.0 110.427 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . 0.41 ' ND1' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -72.14 51.11 0.23 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.302 -0.863 . . . . 1.0 111.338 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.6 -27.07 0.22 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.536 -0.84 . . . . 1.0 112.62 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.89 26.81 3.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.759 0.314 . . . . 1.0 110.997 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.785 ' HB3' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -49.91 176.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.053 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.572 ' HB3' HD11 ' A' ' 21' ' ' LEU . 41.5 t -55.37 -101.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.671 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' O ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -70.78 75.5 0.61 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.924 0.392 . . . . 1.0 110.707 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 33.05 33.95 0.02 OUTLIER Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.92 -0.582 . . . . 1.0 113.546 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.785 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -69.33 150.73 47.03 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 120.911 0.386 . . . . 1.0 111.181 -179.498 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -101.85 164.22 11.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.655 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.17 115.53 30.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.704 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.483 ' CD2' HG11 ' A' ' 34' ' ' VAL . 23.4 m0 -99.99 100.82 11.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.7 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.71 141.55 28.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.845 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 125.17 50.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.435 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -44.44 -30.18 0.82 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.414 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.3 -67.43 0.92 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.761 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p -69.24 179.31 2.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 1.0 111.118 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -162.23 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 1.0 111.249 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.43 139.12 53.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.54 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 8' ' ' LYS . 2.4 m -133.03 163.69 37.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.279 -0.419 . . . . 1.0 111.167 -179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.45 150.5 21.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.933 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.483 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.6 p -150.84 137.28 11.22 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.998 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.748 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.9 Cg_endo -58.67 140.28 94.27 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.993 2.462 . . . . 1.0 112.564 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -43.14 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.995 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.1 t . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.02 -179.854 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.779 0.323 . . . . 1.0 111.199 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -60.28 155.88 16.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.85 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -66.04 178.3 1.16 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.431 . . . . 1.0 110.989 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.63 HD13 ' N ' ' A' ' 4' ' ' ILE . 0.6 OUTLIER -70.08 121.11 81.93 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.102 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -56.96 141.22 93.72 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.22 1.947 . . . . 1.0 111.706 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.8 pttm -71.69 154.19 41.53 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.908 0.385 . . . . 1.0 111.062 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 20.5 m95 56.04 28.77 13.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.027 -0.533 . . . . 1.0 111.311 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.678 ' C ' HG12 ' A' ' 32' ' ' VAL . 2.0 tptt -109.85 152.59 25.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.284 -0.417 . . . . 1.0 110.754 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.69 162.83 0.05 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.219 -0.515 . . . . 1.0 113.214 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -95.15 -8.58 35.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.547 0.213 . . . . 1.0 111.498 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.5 HG12 ' N ' ' A' ' 12' ' ' ASN . 22.0 t -41.19 159.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.473 -0.33 . . . . 1.0 111.413 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.5 ' N ' HG12 ' A' ' 11' ' ' VAL . 56.8 t-20 75.2 83.36 0.1 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.979 0.418 . . . . 1.0 110.285 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 12' ' ' ASN . 21.9 mmt-85 83.21 -16.71 0.55 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.482 -0.781 . . . . 1.0 112.07 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 51.61 87.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.796 0.332 . . . . 1.0 111.276 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.03 34.46 2.76 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.664 -0.779 . . . . 1.0 112.536 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -99.95 24.89 7.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.652 0.263 . . . . 1.0 111.048 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 35.2 m -42.91 150.45 0.16 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.056 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.2 t -70.13 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.91 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.438 ' N ' HD11 ' A' ' 21' ' ' LEU . 7.6 mt-10 -61.89 -154.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 110.231 -0.285 . . . . 1.0 110.231 179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -78.55 28.46 2.08 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.753 -0.736 . . . . 1.0 112.941 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.798 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.77 144.19 52.76 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.715 0.293 . . . . 1.0 110.624 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.624 ' O ' HG22 ' A' ' 34' ' ' VAL . 9.8 pt-20 -106.65 137.15 45.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.388 -0.369 . . . . 1.0 111.002 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.95 112.4 20.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.992 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.465 ' CD2' HG21 ' A' ' 34' ' ' VAL . 31.4 m0 -95.1 122.13 37.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.068 -0.515 . . . . 1.0 110.915 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -84.8 133.86 34.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.871 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.64 -159.69 0.09 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.591 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.24 -51.47 52.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.348 -0.387 . . . . 1.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -128.52 -43.11 1.43 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 1.0 110.905 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 p -57.53 177.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.15 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' CD1' ' N ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -66.04 -167.14 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.463 -179.706 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.432 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -111.04 161.32 16.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.403 179.615 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.678 HG12 ' C ' ' A' ' 8' ' ' LYS . 2.0 m -131.74 127.66 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 1.0 111.179 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.6 m -61.73 127.4 31.24 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.768 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.624 HG22 ' O ' ' A' ' 22' ' ' GLU . 14.6 m -124.68 115.04 26.83 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.153 -0.476 . . . . 1.0 110.759 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.798 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.3 Cg_endo -59.16 134.52 59.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.622 2.215 . . . . 1.0 112.69 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.993 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.442 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -70.17 139.87 87.73 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.556 -0.293 . . . . 1.0 110.598 179.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 57.5 Cg_endo -92.67 -88.93 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 122.944 2.43 . . . . 1.0 112.529 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.27 -78.6 0.07 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.783 0.325 . . . . 1.0 111.115 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 66.6 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.227 -0.892 . . . . 1.0 110.946 -179.952 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.822 0.344 . . . . 1.0 111.397 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -60.15 119.09 7.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.847 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.02 177.71 0.23 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.282 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.754 HG22 ' HD2' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -70.34 147.66 95.25 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.721 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.754 ' HD2' HG22 ' A' ' 4' ' ' ILE . 1.7 Cg_endo -79.83 119.6 4.04 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.563 2.175 . . . . 1.0 111.461 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.89 145.23 46.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.896 0.379 . . . . 1.0 111.009 -179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.425 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 9.4 m95 59.7 49.21 8.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.997 -0.547 . . . . 1.0 111.501 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.713 ' O ' HG13 ' A' ' 32' ' ' VAL . 2.8 mmtp -141.89 165.77 26.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.868 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -43.48 145.36 1.34 Allowed Glycine 0 C--N 1.331 0.263 0 CA-C-N 116.005 -0.543 . . . . 1.0 113.191 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.438 ' O ' ' N ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -95.66 0.76 53.06 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.386 0.143 . . . . 1.0 111.386 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.511 HG22 ' CE2' ' A' ' 30' ' ' PHE . 21.7 t -53.58 86.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 120.977 0.418 . . . . 1.0 111.559 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 10' ' ' CYS . 2.1 t-20 175.41 81.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.415 179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.6 mmt-85 68.57 10.58 7.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.19 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 45.98 71.19 0.31 Allowed 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.899 0.381 . . . . 1.0 111.445 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 123.95 40.75 0.44 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.62 -0.8 . . . . 1.0 113.012 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -100.46 23.02 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.427 0.156 . . . . 1.0 110.931 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.457 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 29.8 m -47.25 151.83 0.66 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.642 -0.254 . . . . 1.0 110.889 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.41 ' N ' HG12 ' A' ' 4' ' ' ILE . 28.3 t -67.81 -97.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.15 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' HG3' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.87 -155.03 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.214 -0.291 . . . . 1.0 110.214 179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -72.88 31.37 0.75 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.651 -0.785 . . . . 1.0 114.346 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.674 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -78.16 147.14 34.67 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 117.591 0.696 . . . . 1.0 110.603 179.358 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -102.85 150.82 23.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.964 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.0 t -91.19 112.41 24.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.901 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.0 m0 -105.68 163.66 12.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 1.0 110.988 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.7 ptmt -116.68 151.71 35.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.123 -0.49 . . . . 1.0 110.911 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.41 126.09 53.08 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.591 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.89 -38.67 4.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.946 -0.57 . . . . 1.0 111.074 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.78 -68.11 0.83 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.902 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.58 176.19 3.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 1.0 110.797 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.511 ' CE2' HG22 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.25 -152.67 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.913 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.405 ' C ' HG23 ' A' ' 32' ' ' VAL . 37.1 mt-10 -95.56 160.35 14.55 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-O 120.664 0.268 . . . . 1.0 110.687 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.713 HG13 ' O ' ' A' ' 8' ' ' LYS . 99.8 t -155.93 140.33 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.461 -0.336 . . . . 1.0 111.278 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 20.3 m -75.05 139.01 42.54 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.257 -0.429 . . . . 1.0 110.513 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 34' ' ' VAL . 29.0 m -128.29 120.92 21.28 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-O 120.491 0.186 . . . . 1.0 111.284 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.674 ' HB3' HD23 ' A' ' 21' ' ' LEU . 36.6 Cg_endo -61.34 141.86 94.02 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.04 2.494 . . . . 1.0 112.325 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -48.73 -76.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.131 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 37' ' ' THR . 5.6 t -69.77 110.56 6.75 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.23 71.42 0.28 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.736 2.291 . . . . 1.0 112.249 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.31 -63.69 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 1.0 111.198 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.225 -0.893 . . . . 1.0 111.049 179.871 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.836 0.351 . . . . 1.0 111.066 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -60.34 86.27 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.922 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -65.85 168.28 8.21 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.224 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.767 HG21 ' HA ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -70.11 125.13 91.86 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.529 -0.305 . . . . 1.0 111.255 -179.683 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.13 124.39 14.29 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.492 2.128 . . . . 1.0 112.119 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.465 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.88 -170.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.03 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.465 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 31.5 p-90 43.09 47.6 5.19 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.04 -0.527 . . . . 1.0 111.301 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.404 ' CD ' ' C ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -134.13 158.55 43.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.584 179.772 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -77.15 143.61 28.77 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.686 -0.769 . . . . 1.0 112.255 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 13' ' ' ARG . 2.2 p -116.14 34.39 5.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.799 0.333 . . . . 1.0 111.31 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.0 t -54.56 128.23 14.25 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.329 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 59.5 18.92 7.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.279 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 mmm180 -149.66 66.2 1.0 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.256 0.55 . . . . 1.0 110.801 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.73 50.32 0.83 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.674 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 171.66 33.01 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.783 -0.723 . . . . 1.0 113.045 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.42 4.45 41.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.517 0.199 . . . . 1.0 110.628 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.767 ' HA ' HG21 ' A' ' 4' ' ' ILE . 86.6 m -70.34 148.52 48.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.788 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.446 ' N ' HG22 ' A' ' 4' ' ' ILE . 12.5 t -69.96 -93.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.366 -0.379 . . . . 1.0 110.897 -179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.41 -159.6 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.6 0.238 . . . . 1.0 110.747 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.29 41.38 2.46 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.587 -0.816 . . . . 1.0 112.751 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.573 HD23 ' CA ' ' A' ' 35' ' ' PRO . 1.2 mp -69.84 164.84 22.81 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 120.972 0.415 . . . . 1.0 111.389 -179.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.544 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.7 OUTLIER -135.24 134.01 39.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.661 179.801 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.18 107.36 9.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.942 0.401 . . . . 1.0 110.82 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -93.45 126.12 38.42 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.292 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -74.17 136.98 42.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.174 -0.467 . . . . 1.0 110.812 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.6 mtp85 -91.21 -162.97 0.97 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.584 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -70.03 -66.6 0.57 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.95 0.405 . . . . 1.0 110.904 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -104.21 -52.37 2.94 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.79 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.88 171.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.962 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -68.6 -157.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.761 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 5.4 pt-20 -102.3 138.41 39.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.115 0.483 . . . . 1.0 110.909 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.1 m -109.6 135.17 49.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.113 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 21' ' ' LEU . 14.2 t -59.72 135.85 57.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.093 -0.503 . . . . 1.0 111.414 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' GLU . 12.4 p -143.05 132.91 11.97 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-O 120.715 0.293 . . . . 1.0 111.363 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.573 ' CA ' HD23 ' A' ' 21' ' ' LEU . 32.6 Cg_endo -59.97 140.14 91.34 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.922 2.414 . . . . 1.0 112.576 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -66.37 -47.04 74.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 1.0 110.988 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.7 HG22 ' HD2' ' A' ' 38' ' ' PRO . 0.2 OUTLIER -70.08 151.88 95.94 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.89 -0.595 . . . . 1.0 110.939 -179.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.7 ' HD2' HG22 ' A' ' 37' ' ' THR . 3.6 Cg_exo -76.82 86.24 1.63 Allowed 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.853 2.369 . . . . 1.0 112.126 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.8 138.59 58.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.933 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.5 m . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.197 -0.906 . . . . 1.0 110.815 -179.913 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.592 0.234 . . . . 1.0 111.26 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.26 122.79 14.06 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.047 0.451 . . . . 1.0 110.96 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.15 163.76 5.89 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.044 -0.526 . . . . 1.0 111.061 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.415 ' CD1' ' HA ' ' A' ' 17' ' ' CYS . 1.8 pp -70.05 147.37 95.69 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.432 -0.349 . . . . 1.0 111.216 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 19.2 Cg_exo -64.11 130.7 28.05 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.622 2.215 . . . . 1.0 111.955 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -59.17 149.86 27.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 1.0 110.661 179.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.4 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 0.2 OUTLIER 63.11 36.42 12.22 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.836 -179.588 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.519 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -101.19 149.95 23.46 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.173 -0.467 . . . . 1.0 110.477 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.519 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -45.58 173.83 0.01 OUTLIER Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.3 -0.476 . . . . 1.0 113.531 -179.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.427 ' O ' ' N ' ' A' ' 12' ' ' ASN . 19.3 t -104.45 -12.63 16.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.585 0.231 . . . . 1.0 111.424 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 16.3 t -58.97 82.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.993 0.425 . . . . 1.0 111.206 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.427 ' N ' ' O ' ' A' ' 10' ' ' CYS . 6.0 t-20 177.46 75.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.473 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.412 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.0 OUTLIER 65.51 14.99 9.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 1.0 111.421 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 48.28 84.1 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.786 0.327 . . . . 1.0 111.334 179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 109.37 53.31 0.6 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.58 -0.819 . . . . 1.0 112.517 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -111.43 20.73 16.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.562 0.22 . . . . 1.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.415 ' HA ' ' CD1' ' A' ' 4' ' ' ILE . 4.2 m -61.9 163.71 7.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.514 -0.312 . . . . 1.0 110.444 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 17.6 t -55.35 -94.71 0.0 OUTLIER 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.77 -0.195 . . . . 1.0 110.798 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -66.64 -154.94 0.01 OUTLIER 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.1 -0.333 . . . . 1.0 110.1 179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.49 33.27 1.59 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 1.0 113.001 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.814 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -69.71 151.47 45.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.93 0.365 . . . . 1.0 111.138 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.739 ' O ' HG12 ' A' ' 34' ' ' VAL . 1.5 pm0 -118.67 134.48 55.09 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.165 0.507 . . . . 1.0 110.291 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 14.6 p -79.1 126.9 31.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.083 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 33.0 m0 -108.78 135.99 49.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.011 -0.54 . . . . 1.0 111.203 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 14.5 tptm -90.1 134.65 34.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.458 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 174.93 5.67 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.084 0.468 . . . . 1.0 110.673 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -73.05 0.18 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.804 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -71.01 -66.98 0.54 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.548 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.3 p -69.28 152.14 45.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.213 -0.448 . . . . 1.0 110.714 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -147.11 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.731 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 8.5 mt-10 -89.92 169.44 11.23 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.841 0.353 . . . . 1.0 110.756 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -159.71 139.9 3.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.919 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 33.8 m -69.97 140.37 52.97 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.176 -0.466 . . . . 1.0 111.059 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 22' ' ' GLU . 7.2 p -143.2 138.24 15.48 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.674 -0.239 . . . . 1.0 111.095 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.814 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.3 Cg_endo -58.16 139.92 92.28 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.927 2.418 . . . . 1.0 112.747 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.535 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -51.18 -39.05 55.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 1.0 110.974 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.535 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 8.8 t -65.11 145.5 99.08 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.901 -0.591 . . . . 1.0 110.719 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 3.0 Cg_exo -75.38 -70.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.668 2.245 . . . . 1.0 112.087 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.2 ttmm -67.05 130.84 44.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 1.0 110.988 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.496 ' O ' HG22 ' A' ' 40' ' ' THR . 7.4 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.108 -0.948 . . . . 1.0 110.788 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.943 0.401 . . . . 1.0 111.244 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.25 116.18 4.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.175 -0.466 . . . . 1.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 2.4 m -70.16 -95.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.702 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 17' ' ' CYS . 11.0 tt -70.63 140.98 87.22 Favored Pre-proline 0 N--CA 1.455 -0.183 0 O-C-N 122.393 -0.192 . . . . 1.0 110.798 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.432 ' O ' ' HB2' ' A' ' 8' ' ' LYS . 44.3 Cg_exo -54.19 113.18 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.085 1.857 . . . . 1.0 111.828 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.23 145.67 46.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.875 0.369 . . . . 1.0 110.806 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 8.8 m0 67.68 19.35 9.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.805 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.535 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.4 OUTLIER -110.23 173.8 6.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.729 0.299 . . . . 1.0 110.806 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -57.3 150.94 28.68 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.836 -0.697 . . . . 1.0 112.63 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.411 ' O ' ' N ' ' A' ' 12' ' ' ASN . 21.0 p -115.1 19.06 15.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.475 0.179 . . . . 1.0 111.311 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.47 82.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.85 0.357 . . . . 1.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' A' ' 10' ' ' CYS . 4.6 t-20 177.59 81.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.49 . . . . 1.0 110.568 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 73.84 5.47 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.742 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.23 83.63 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.105 0 CA-C-O 120.888 0.375 . . . . 1.0 111.33 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.08 34.41 0.89 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.596 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.64 22.03 13.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.664 0.269 . . . . 1.0 110.858 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.478 ' HA ' HG21 ' A' ' 4' ' ' ILE . 11.6 m -58.41 165.59 2.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.737 0.303 . . . . 1.0 110.674 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 39.5 t -70.24 -88.57 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.387 -0.369 . . . . 1.0 111.915 -179.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -67.88 66.47 0.1 Allowed 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.879 0.371 . . . . 1.0 111.702 -178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 39.97 26.64 0.1 Allowed Glycine 0 C--O 1.225 -0.433 0 C-N-CA 121.228 -0.511 . . . . 1.0 113.817 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.27 151.16 46.6 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 120.983 0.42 . . . . 1.0 110.576 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -101.54 159.03 15.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.103 0.478 . . . . 1.0 110.774 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 41.8 t -98.51 120.25 38.61 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.921 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.592 ' CD2' HG11 ' A' ' 34' ' ' VAL . 30.7 m0 -109.69 130.98 55.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.78 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.69 148.29 25.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.868 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.7 mmt-85 -114.03 129.51 56.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.643 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.13 -30.39 1.12 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.939 -0.573 . . . . 1.0 111.448 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.98 -82.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.63 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 47.6 p -70.14 -177.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.915 0.388 . . . . 1.0 110.949 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -153.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.662 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -113.32 136.83 52.33 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.806 0.336 . . . . 1.0 110.747 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.535 HG12 ' C ' ' A' ' 8' ' ' LYS . 9.7 m -126.04 163.99 26.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.302 -0.408 . . . . 1.0 111.374 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 18.3 m -69.23 161.07 29.98 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.738 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.592 HG11 ' CD2' ' A' ' 24' ' ' TRP . 8.9 p -170.33 138.16 1.36 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.382 -0.372 . . . . 1.0 110.938 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.482 ' HD2' HG23 ' A' ' 34' ' ' VAL . 18.5 Cg_endo -53.85 136.04 64.8 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.004 2.469 . . . . 1.0 112.554 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -89.51 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.326 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -70.21 142.46 89.93 Favored Pre-proline 0 CA--C 1.53 0.188 0 O-C-N 122.397 -0.19 . . . . 1.0 110.926 -179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 9.2 Cg_endo -88.36 150.11 6.55 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 123.102 2.535 . . . . 1.0 112.079 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.61 82.65 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.302 -0.408 . . . . 1.0 110.945 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.31 -0.852 . . . . 1.0 110.848 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.92 0.391 . . . . 1.0 111.289 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -58.6 124.76 20.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.934 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 19.4 m -66.0 147.75 52.87 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.328 -0.396 . . . . 1.0 110.776 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.447 HD11 ' HA ' ' A' ' 17' ' ' CYS . 2.1 pp -70.1 141.76 89.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.229 . . . . 1.0 111.207 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -68.45 140.24 47.43 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.534 2.156 . . . . 1.0 111.95 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -71.72 162.95 28.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 24.3 m0 60.14 31.48 20.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.024 -0.535 . . . . 1.0 111.271 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -120.06 147.72 44.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.517 179.867 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.666 ' CA ' HG12 ' A' ' 32' ' ' VAL . . . -71.07 136.68 25.62 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.059 -0.591 . . . . 1.0 112.845 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -94.32 27.45 2.91 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.689 0.281 . . . . 1.0 111.009 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.1 p -67.6 70.26 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 1.0 110.987 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -177.22 -70.51 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.913 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.455 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 7.5 mmm180 -95.84 -9.49 31.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.342 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 53.63 92.41 0.02 OUTLIER 'General case' 0 CA--C 1.523 -0.088 0 CA-C-O 121.087 0.47 . . . . 1.0 110.832 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 84.72 48.81 4.81 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.238 -179.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.464 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 0.0 OUTLIER -88.08 5.27 41.9 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.515 -0.342 . . . . 1.0 111.204 -179.113 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 21' ' ' LEU . 57.3 m -45.69 138.8 4.4 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.946 0.403 . . . . 1.0 111.779 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 t -70.4 -83.31 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.024 -0.534 . . . . 1.0 110.377 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' H ' HD11 ' A' ' 21' ' ' LEU . 14.2 mt-10 -63.79 -153.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.608 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.82 17.98 3.34 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.625 -0.797 . . . . 1.0 113.173 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.535 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.0 OUTLIER -69.69 144.3 52.89 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 117.098 0.449 . . . . 1.0 110.525 179.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -116.07 160.01 20.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.866 0.365 . . . . 1.0 110.928 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -91.61 109.71 21.02 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.85 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 36.9 m0 -115.64 149.54 38.16 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.29 -0.413 . . . . 1.0 111.291 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -70.7 128.4 35.94 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.006 -0.543 . . . . 1.0 110.93 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.529 ' HD2' HG21 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -86.88 -162.61 0.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.563 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -68.12 0.44 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.794 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.3 ttp-105 -103.89 -43.08 5.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 1.0 110.86 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.9 p -67.73 157.37 34.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.996 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.48 -158.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.433 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HA ' ' HA ' ' A' ' 25' ' ' LYS . 44.0 mt-10 -80.26 124.56 28.93 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 120.978 0.418 . . . . 1.0 110.887 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.666 HG12 ' CA ' ' A' ' 9' ' ' GLY . 34.7 m -117.3 160.99 16.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.976 -0.556 . . . . 1.0 111.048 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 5.0 m -69.51 142.41 53.69 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.284 -0.416 . . . . 1.0 111.131 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 22' ' ' GLU . 13.0 p -142.34 120.16 7.37 Favored Pre-proline 0 C--N 1.323 -0.557 0 C-N-CA 122.195 0.198 . . . . 1.0 111.073 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.535 ' HB3' HD23 ' A' ' 21' ' ' LEU . 27.6 Cg_endo -57.94 139.08 89.13 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.858 2.372 . . . . 1.0 112.475 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -43.94 -35.83 2.18 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.116 -0.493 . . . . 1.0 111.137 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.43 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 75.8 m -69.87 121.4 82.62 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.639 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 2.5 Cg_endo -80.12 -75.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.808 2.339 . . . . 1.0 112.24 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -70.23 83.27 0.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.992 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.251 1.152 0 CA-C-O 118.158 -0.925 . . . . 1.0 110.97 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.035 0.445 . . . . 1.0 111.147 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -60.62 137.04 58.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.222 -0.444 . . . . 1.0 111.004 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.35 -176.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.216 -0.447 . . . . 1.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.03 142.33 90.29 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.188 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.17 124.88 15.19 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.512 2.141 . . . . 1.0 111.983 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -70.16 150.38 46.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.07 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 7' ' ' TRP . 2.0 m0 67.33 27.27 8.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 1.0 111.184 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.04 169.05 9.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.426 -0.352 . . . . 1.0 110.913 179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.15 152.15 46.48 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.662 -0.78 . . . . 1.0 112.569 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 m -91.91 5.48 49.88 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.407 0.151 . . . . 1.0 111.407 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.571 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.5 p -70.93 65.41 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.085 0.469 . . . . 1.0 110.861 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -177.32 -54.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.871 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.427 ' HB3' ' CB ' ' A' ' 16' ' ' ASP . 1.0 OUTLIER -97.91 -38.28 9.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.138 -0.483 . . . . 1.0 110.814 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.26 84.88 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.049 -0.523 . . . . 1.0 111.448 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.13 -0.88 71.86 Favored Glycine 0 C--O 1.226 -0.373 0 C-N-CA 120.742 -0.742 . . . . 1.0 113.259 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.427 ' CB ' ' HB3' ' A' ' 13' ' ' ARG . 1.0 OUTLIER -98.14 24.13 7.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.985 0.421 . . . . 1.0 110.65 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -51.58 172.63 0.03 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.035 -0.53 . . . . 1.0 111.052 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 29.6 t -64.62 -96.7 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.533 -0.303 . . . . 1.0 111.164 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 21' ' ' LEU . 3.2 mm-40 -65.78 -164.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.14 0 N-CA-C 110.202 -0.296 . . . . 1.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.28 39.53 0.86 Allowed Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.646 -0.788 . . . . 1.0 112.779 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 19' ' ' GLU . 0.4 OUTLIER -69.82 155.14 40.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 120.819 0.343 . . . . 1.0 111.157 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.524 ' OE1' HG23 ' A' ' 34' ' ' VAL . 0.2 OUTLIER -127.98 135.81 50.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.598 179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 56.5 m -74.78 127.59 33.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.009 -0.541 . . . . 1.0 111.134 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.468 ' CD2' HG21 ' A' ' 34' ' ' VAL . 18.9 m0 -119.28 133.95 55.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.877 -179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -83.14 148.07 27.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.768 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.53 -168.18 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.835 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.15 -76.16 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.133 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -79.44 -59.45 2.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.178 -0.464 . . . . 1.0 110.923 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.58 162.25 3.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.736 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -82.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.792 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -159.53 144.38 15.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 1.0 111.073 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 2.9 m -125.94 143.23 40.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.287 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 148.92 51.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.249 179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.524 HG23 ' OE1' ' A' ' 22' ' ' GLU . 2.2 m -147.46 132.87 9.21 Favored Pre-proline 0 C--N 1.323 -0.562 0 C-N-CA 122.401 0.281 . . . . 1.0 111.245 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -57.27 136.37 75.9 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.875 2.383 . . . . 1.0 112.685 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -68.96 -45.7 70.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.02 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 37' ' ' THR . 10.1 t -47.1 104.94 0.44 Allowed Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.446 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.57 -157.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.757 2.305 . . . . 1.0 112.217 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.25 149.28 29.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.38 -0.373 . . . . 1.0 110.926 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.237 -0.887 . . . . 1.0 110.89 179.962 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.838 0.352 . . . . 1.0 111.233 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -60.14 149.58 32.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.876 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.98 163.71 11.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.223 -0.444 . . . . 1.0 111.307 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.576 HG23 ' O ' ' A' ' 4' ' ' ILE . 8.0 tp -70.18 116.38 43.99 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.351 -0.386 . . . . 1.0 111.291 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.48 117.59 4.33 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.391 2.061 . . . . 1.0 111.885 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.62 169.71 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.319 -0.4 . . . . 1.0 111.18 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 25.4 m95 61.82 38.15 14.97 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.075 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -143.25 164.34 30.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.78 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.73 136.22 47.71 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.757 -0.735 . . . . 1.0 112.539 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.4 p -117.36 21.83 12.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.654 0.264 . . . . 1.0 111.275 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -59.05 87.84 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 120.901 0.381 . . . . 1.0 111.101 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -176.84 78.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 1.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 70.75 5.18 5.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.83 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 44.24 83.04 0.03 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 121.015 0.436 . . . . 1.0 111.412 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.25 10.29 1.96 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.67 -0.776 . . . . 1.0 113.143 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.89 11.84 23.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 117.226 0.513 . . . . 1.0 111.162 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.572 ' SG ' HG21 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -57.76 179.63 0.06 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.484 -0.326 . . . . 1.0 110.891 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.8 t -68.99 -95.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.692 -0.231 . . . . 1.0 111.036 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.91 -155.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.212 -0.292 . . . . 1.0 110.212 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -80.76 34.71 2.31 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 120.725 -0.75 . . . . 1.0 112.784 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.759 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.48 152.77 44.46 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 120.781 0.324 . . . . 1.0 111.023 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.3 pt-20 -116.85 158.39 24.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.917 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.0 m -86.69 113.85 22.89 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.902 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.797 ' CD2' HG11 ' A' ' 34' ' ' VAL . 18.8 m0 -108.4 136.4 48.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.822 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -88.18 150.85 23.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.037 0.446 . . . . 1.0 110.948 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -110.39 122.58 48.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.05 -0.523 . . . . 1.0 110.679 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -46.31 -40.5 11.84 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.0 111.275 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -92.51 -75.94 0.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.009 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.13 -176.11 0.68 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.153 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -149.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 1.0 110.728 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -88.33 176.1 7.36 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.764 0.316 . . . . 1.0 110.677 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 11.6 p -170.11 144.81 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.451 -0.341 . . . . 1.0 111.388 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 153.63 40.03 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.96 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.797 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.1 p -146.53 137.23 12.48 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 116.727 -0.215 . . . . 1.0 111.547 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.759 ' HA ' HD23 ' A' ' 21' ' ' LEU . 36.8 Cg_endo -61.36 145.79 97.91 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.953 2.435 . . . . 1.0 112.464 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -131.54 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.331 -0.395 . . . . 1.0 110.48 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 68.5 m -70.27 143.56 91.06 Favored Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.614 0.245 . . . . 1.0 110.878 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 63.3 Cg_endo -88.45 -49.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 122.71 2.273 . . . . 1.0 112.864 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -55.84 112.88 1.28 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.489 -0.323 . . . . 1.0 111.102 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.198 -0.906 . . . . 1.0 110.798 179.935 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 121.162 0.506 . . . . 1.0 111.171 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.5 p-10 -60.18 118.03 5.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.812 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.2 177.11 0.19 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.178 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.561 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.6 pp -58.15 161.23 7.51 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.515 -0.311 . . . . 1.0 111.375 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -81.97 112.16 2.29 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.019 2.479 . . . . 1.0 111.774 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 pttt -58.3 155.48 11.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.918 0.389 . . . . 1.0 111.163 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 10.4 m95 60.38 43.38 13.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.349 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' C ' HG12 ' A' ' 32' ' ' VAL . 4.6 mmtp -142.6 170.16 16.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.838 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.94 162.85 6.9 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.77 -0.729 . . . . 1.0 112.607 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.407 ' O ' ' N ' ' A' ' 12' ' ' ASN . 3.2 m -127.03 19.23 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.426 0.155 . . . . 1.0 111.302 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.0 t -57.42 85.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.78 0.324 . . . . 1.0 111.218 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 10' ' ' CYS . 30.4 t-20 179.76 80.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 1.0 110.526 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 1.2 mmm180 68.28 13.59 9.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.118 -0.492 . . . . 1.0 111.264 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.94 37.1 4.55 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.406 -0.361 . . . . 1.0 111.455 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 174.15 37.23 0.04 OUTLIER Glycine 0 C--O 1.226 -0.368 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.999 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -103.8 15.04 29.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.531 0.205 . . . . 1.0 110.962 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.12 174.86 4.99 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.587 -0.278 . . . . 1.0 110.655 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.402 ' HB3' HD11 ' A' ' 21' ' ' LEU . 51.3 t -70.03 -105.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.753 -0.203 . . . . 1.0 111.045 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.43 ' N ' HD11 ' A' ' 21' ' ' LEU . 6.4 mm-40 -60.23 -161.47 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 110.163 -0.31 . . . . 1.0 110.163 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.48 39.41 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.413 -0.899 . . . . 1.0 112.87 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.661 HD23 ' HB3' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -70.01 147.95 49.47 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 120.823 0.344 . . . . 1.0 110.947 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.3 OUTLIER -117.03 153.56 32.49 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.003 0.43 . . . . 1.0 110.647 179.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -96.19 114.37 26.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.282 -0.417 . . . . 1.0 110.883 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -103.47 129.8 50.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.075 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -84.64 134.66 34.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.704 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -163.55 0.85 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.84 0.353 . . . . 1.0 110.641 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -79.7 0.06 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.636 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.47 -39.25 10.52 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.593 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.97 167.99 4.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.846 -0.616 . . . . 1.0 111.024 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -156.42 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.114 -0.493 . . . . 1.0 110.92 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 18.6 pt-20 -107.35 155.08 20.39 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.828 0.346 . . . . 1.0 110.721 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.426 HG12 ' C ' ' A' ' 8' ' ' LYS . 0.3 OUTLIER -141.18 138.57 33.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.263 -0.426 . . . . 1.0 111.315 -179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -59.65 155.26 16.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.837 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.609 HG12 ' O ' ' A' ' 22' ' ' GLU . 5.9 p -155.28 116.72 2.36 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.024 179.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.661 ' HB3' HD23 ' A' ' 21' ' ' LEU . 30.7 Cg_endo -60.0 137.76 77.89 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.764 2.309 . . . . 1.0 112.596 -179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.2 -67.41 0.26 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.907 -0.588 . . . . 1.0 111.436 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.7 t -70.44 147.81 95.12 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.543 -0.298 . . . . 1.0 111.075 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.23 -64.27 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 122.822 2.348 . . . . 1.0 112.151 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.49 114.28 3.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.966 -0.561 . . . . 1.0 111.001 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 64.4 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.073 -0.965 . . . . 1.0 110.861 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.953 0.406 . . . . 1.0 111.096 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.5 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.164 -0.471 . . . . 1.0 111.21 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.5 m -69.76 143.75 52.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.091 -0.504 . . . . 1.0 111.433 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.441 HD12 ' O ' ' A' ' 5' ' ' PRO . 2.5 pp -70.1 144.7 93.0 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.402 -0.363 . . . . 1.0 111.287 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.441 ' O ' HD12 ' A' ' 4' ' ' ILE . 41.9 Cg_exo -55.11 140.71 80.65 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.382 2.055 . . . . 1.0 112.052 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.439 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 18.0 pttt -96.02 30.81 2.3 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.996 0.427 . . . . 1.0 111.198 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.439 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 8.6 m95 -148.21 29.3 0.88 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.754 -0.657 . . . . 1.0 110.737 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.753 ' O ' HG23 ' A' ' 32' ' ' VAL . 27.9 mmtm -118.68 161.69 19.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.907 0.385 . . . . 1.0 110.999 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 31' ' ' GLU . . . -54.71 -179.16 0.18 Allowed Glycine 0 C--N 1.329 0.163 0 C-N-CA 121.053 -0.594 . . . . 1.0 112.434 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.403 ' CB ' ' HB2' ' A' ' 31' ' ' GLU . 1.6 t -131.86 11.03 4.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 111.607 0.225 . . . . 1.0 111.607 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 11' ' ' VAL . 13.0 p -77.32 55.07 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-O 120.949 0.404 . . . . 1.0 111.092 179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 51.5 t-20 172.96 -36.88 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.111 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 mmt-85 -81.46 -52.18 7.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.779 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 51.43 67.05 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.121 0.486 . . . . 1.0 110.937 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.55 26.08 66.3 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.813 -0.708 . . . . 1.0 112.271 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.77 23.43 11.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.619 0.247 . . . . 1.0 110.919 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.44 ' HA ' HD11 ' A' ' 4' ' ' ILE . 3.5 m -58.65 167.56 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.311 -0.404 . . . . 1.0 110.388 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 19' ' ' GLU . 0.8 OUTLIER -60.31 -85.64 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.531 -179.775 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.432 ' N ' ' SG ' ' A' ' 18' ' ' CYS . 22.9 mt-10 -70.34 -161.89 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.06 37.76 1.32 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.373 -0.918 . . . . 1.0 112.342 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.0 154.2 42.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 121.069 0.461 . . . . 1.0 110.95 -179.666 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.575 ' O ' HG12 ' A' ' 34' ' ' VAL . 0.5 OUTLIER -109.72 149.86 29.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.315 179.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.25 98.74 9.97 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 1.0 110.537 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.656 ' CD2' HG11 ' A' ' 34' ' ' VAL . 42.6 m0 -76.74 133.55 39.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.983 -0.553 . . . . 1.0 111.131 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -84.56 165.82 17.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.028 -0.533 . . . . 1.0 110.777 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -144.06 148.79 35.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.696 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 -56.12 -54.57 43.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.995 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 mtp85 -70.32 -80.96 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 1.0 110.624 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 p -70.12 163.04 27.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.765 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -80.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.657 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.419 ' O ' ' HA2' ' A' ' 9' ' ' GLY . 18.2 mt-10 -154.82 -167.97 2.75 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.481 -0.327 . . . . 1.0 110.743 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.753 HG23 ' O ' ' A' ' 8' ' ' LYS . 7.3 p -170.28 142.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.324 -0.398 . . . . 1.0 111.027 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 9.8 m -67.01 159.99 27.47 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.502 -0.317 . . . . 1.0 110.621 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.656 HG11 ' CD2' ' A' ' 24' ' ' TRP . 7.7 p -173.18 137.55 0.77 Allowed Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 111.613 0.227 . . . . 1.0 111.613 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.815 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.2 Cg_endo -59.01 140.86 97.23 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.955 2.437 . . . . 1.0 112.418 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mmmm -60.34 -78.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.84 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.537 HG22 HG23 ' A' ' 40' ' ' THR . 80.0 m -70.21 107.89 2.88 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.347 -0.388 . . . . 1.0 110.792 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 9.2 Cg_endo -88.16 -77.87 0.0 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.229 0 C-N-CA 122.976 2.45 . . . . 1.0 112.333 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.26 124.09 23.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.404 -0.362 . . . . 1.0 110.927 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.537 HG23 HG22 ' A' ' 37' ' ' THR . 1.5 p . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.206 -0.902 . . . . 1.0 110.843 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.801 0.334 . . . . 1.0 111.268 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -67.17 74.13 0.12 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.127 -0.488 . . . . 1.0 111.221 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.0 157.51 36.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.756 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.847 HD11 ' HG3' ' A' ' 8' ' ' LYS . 0.5 OUTLIER -70.14 117.6 55.85 Favored Pre-proline 0 N--CA 1.454 -0.263 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.081 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.8 171.78 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.633 2.222 . . . . 1.0 112.852 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.494 ' HB3' ' HD3' ' A' ' 35' ' ' PRO . 34.0 pttt -87.39 50.45 2.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.927 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.454 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.0 m95 -147.99 29.32 0.9 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.433 -0.349 . . . . 1.0 111.1 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.847 ' HG3' HD11 ' A' ' 4' ' ' ILE . 9.6 tmtm? -116.69 137.98 51.79 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.27 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.412 ' O ' ' HD3' ' A' ' 8' ' ' LYS . . . -50.18 144.87 9.93 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.997 -0.62 . . . . 1.0 112.671 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 p -109.99 7.34 23.67 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.755 0.28 . . . . 1.0 111.755 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.592 HG22 ' OE2' ' A' ' 31' ' ' GLU . 34.8 t -61.95 138.22 22.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.538 0.209 . . . . 1.0 110.516 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.1 t-20 68.88 84.53 0.15 Allowed 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.207 0.527 . . . . 1.0 109.629 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 1.2 mmm180 76.39 82.32 0.09 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.075 -0.966 . . . . 1.0 109.845 -178.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -67.48 49.74 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.986 -1.006 . . . . 1.0 111.897 -179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -160.66 22.26 0.24 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 121.169 -0.539 . . . . 1.0 112.356 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.36 -6.86 59.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.616 0.246 . . . . 1.0 110.982 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.836 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.9 t -69.73 -159.81 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.788 -0.449 . . . . 1.0 109.788 179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.469 ' N ' ' CG2' ' A' ' 4' ' ' ILE . 42.3 t -70.31 -105.29 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.15 0.426 . . . . 1.0 112.15 -178.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.637 ' O ' HD12 ' A' ' 21' ' ' LEU . 0.9 OUTLIER -70.43 -160.46 0.04 OUTLIER 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 120.566 0.222 . . . . 1.0 110.851 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.18 47.67 2.66 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.549 -0.834 . . . . 1.0 112.313 179.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.836 HD13 ' HB3' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -69.4 144.15 53.44 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.915 0.388 . . . . 1.0 110.763 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.5 165.68 23.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.232 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.8 t -108.27 107.2 17.7 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.851 -0.613 . . . . 1.0 110.571 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -102.22 126.97 49.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.83 145.05 29.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.619 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 28.1 mmm-85 -107.02 123.08 47.68 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.742 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -46.31 -29.88 1.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.025 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -101.57 -70.99 0.73 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.74 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.8 p -70.15 179.59 2.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.954 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.96 -155.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.967 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' HG22 ' A' ' 11' ' ' VAL . 7.9 mt-10 -99.24 -178.47 3.93 Favored 'General case' 0 N--CA 1.458 -0.071 0 CA-C-N 116.614 -0.267 . . . . 1.0 110.535 179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.481 HG22 ' N ' ' A' ' 33' ' ' CYS . 4.8 p -170.21 157.39 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.811 0.339 . . . . 1.0 111.82 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.481 ' N ' HG22 ' A' ' 32' ' ' VAL . 4.5 p -99.54 117.63 34.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.789 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 34' ' ' VAL . 13.5 p -109.32 117.27 53.51 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.68 -0.236 . . . . 1.0 111.61 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.777 ' HB3' HD23 ' A' ' 21' ' ' LEU . 29.1 Cg_endo -59.79 132.08 43.32 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.843 2.362 . . . . 1.0 113.14 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -70.71 -47.18 61.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.598 -0.728 . . . . 1.0 110.654 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.406 ' OG1' ' HD2' ' A' ' 38' ' ' PRO . 12.9 t -60.86 155.85 50.37 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.959 -0.564 . . . . 1.0 110.998 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.406 ' HD2' ' OG1' ' A' ' 37' ' ' THR . 17.0 Cg_exo -68.09 145.46 67.21 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.693 2.262 . . . . 1.0 112.187 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -177.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.269 -0.423 . . . . 1.0 111.037 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 73.8 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.267 -0.873 . . . . 1.0 110.965 -179.851 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.84 0.352 . . . . 1.0 111.129 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.86 77.55 0.08 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.98 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 m -59.43 172.67 0.62 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.213 -0.449 . . . . 1.0 111.061 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 5' ' ' PRO . 1.8 pp -69.96 140.55 88.72 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.265 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.424 ' O ' HD12 ' A' ' 4' ' ' ILE . 23.7 Cg_exo -62.2 149.96 88.62 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.391 2.06 . . . . 1.0 112.03 179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.489 ' HB3' ' CD1' ' A' ' 7' ' ' TRP . 17.4 mtmm -60.53 165.69 3.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.278 -0.419 . . . . 1.0 110.955 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER 46.91 69.98 0.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 1.0 111.067 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.414 ' HD3' ' N ' ' A' ' 9' ' ' GLY . 4.4 tmtm? -129.46 132.15 46.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.839 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.414 ' N ' ' HD3' ' A' ' 8' ' ' LYS . . . -48.94 139.74 12.58 Favored Glycine 0 C--N 1.33 0.211 0 C-N-CA 121.235 -0.507 . . . . 1.0 112.811 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.8 p -106.04 -3.22 21.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.511 0.196 . . . . 1.0 111.396 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.726 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.6 t -83.25 64.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.827 0.346 . . . . 1.0 111.373 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.41 ' N ' ' OD1' ' A' ' 12' ' ' ASN . 1.4 p30 -153.89 -86.87 0.06 Allowed 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.855 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 -88.15 -11.89 45.58 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.597 0.237 . . . . 1.0 111.32 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 53.81 79.22 0.13 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.0 0.429 . . . . 1.0 110.93 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.67 6.82 6.45 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.818 -0.705 . . . . 1.0 112.743 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -69.89 -13.98 62.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.991 0.395 . . . . 1.0 111.034 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.45 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 84.8 m -59.23 142.49 51.7 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.589 -0.278 . . . . 1.0 110.501 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.427 ' HB3' HD11 ' A' ' 21' ' ' LEU . 46.4 t -56.98 -103.36 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.641 -0.254 . . . . 1.0 111.428 -179.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.456 ' N ' HD11 ' A' ' 21' ' ' LEU . 17.0 mm-40 -63.97 -157.19 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 110.079 -0.341 . . . . 1.0 110.079 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.82 42.4 2.04 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.521 -0.847 . . . . 1.0 112.935 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.684 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.2 OUTLIER -71.68 148.67 46.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 120.8 0.333 . . . . 1.0 110.894 -179.897 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.44 ' OE1' ' CD1' ' A' ' 24' ' ' TRP . 0.1 OUTLIER -123.84 148.85 46.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.186 0.517 . . . . 1.0 110.856 179.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 6.8 p -90.79 119.07 30.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.089 -0.505 . . . . 1.0 111.47 -179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' OE1' ' A' ' 22' ' ' GLU . 35.8 m0 -101.09 125.67 47.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.716 179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 tttp -73.78 136.51 43.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.788 0.328 . . . . 1.0 110.475 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.99 -168.45 1.46 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.331 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -46.92 87.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.933 -0.576 . . . . 1.0 110.622 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.71 -42.3 0.84 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.636 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.3 t -59.07 173.03 0.5 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.011 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.726 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.5 OUTLIER -61.95 -167.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.366 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -111.26 146.24 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.836 -0.62 . . . . 1.0 110.457 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.451 ' HB ' ' HA ' ' A' ' 7' ' ' TRP . 3.9 m -128.36 137.64 56.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.953 0.406 . . . . 1.0 111.377 -179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.1 OUTLIER -61.77 146.49 49.26 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.145 -0.479 . . . . 1.0 111.521 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 22' ' ' GLU . 8.8 p -147.12 127.17 6.73 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.896 -0.593 . . . . 1.0 110.831 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.684 ' CA ' HD23 ' A' ' 21' ' ' LEU . 20.0 Cg_endo -56.91 131.12 43.58 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.877 2.385 . . . . 1.0 112.929 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 ptmm? -70.14 -100.22 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.728 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.41 ' CG2' ' CD ' ' A' ' 38' ' ' PRO . 84.5 m -70.48 149.89 95.62 Favored Pre-proline 0 C--N 1.333 -0.144 0 CA-C-O 120.485 0.183 . . . . 1.0 110.667 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' CD ' ' CG2' ' A' ' 37' ' ' THR . 1.0 OUTLIER -84.2 42.34 1.17 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.975 2.45 . . . . 1.0 112.815 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.19 110.56 5.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.855 0.36 . . . . 1.0 110.768 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 C--O 1.244 0.81 0 CA-C-O 118.37 -0.824 . . . . 1.0 110.727 179.907 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.846 0.355 . . . . 1.0 111.206 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -60.52 118.35 6.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.173 -0.467 . . . . 1.0 111.077 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -62.17 172.79 1.31 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 1.0 111.04 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.489 HD12 ' C ' ' A' ' 4' ' ' ILE . 1.4 pp -70.13 157.82 88.92 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.264 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.46 ' C ' HD12 ' A' ' 4' ' ' ILE . 5.1 Cg_exo -75.12 120.01 5.85 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.781 2.321 . . . . 1.0 111.928 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.44 ' C ' ' CG ' ' A' ' 7' ' ' TRP . 12.1 mttt -51.11 148.02 4.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 1.0 111.363 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.44 ' CG ' ' C ' ' A' ' 6' ' ' LYS . 0.7 OUTLIER 44.04 68.94 0.46 Allowed 'General case' 0 CA--C 1.523 -0.078 0 CA-C-N 115.859 -0.61 . . . . 1.0 111.98 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.43 ' HG3' ' HB2' ' A' ' 5' ' ' PRO . 36.2 mmtt -148.28 173.81 12.65 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.738 -0.665 . . . . 1.0 110.831 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -48.31 152.46 2.34 Favored Glycine 0 C--N 1.329 0.182 0 C-N-CA 121.034 -0.603 . . . . 1.0 112.771 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.454 ' HB2' ' HB2' ' A' ' 31' ' ' GLU . 62.6 m -96.54 0.51 50.21 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.59 0.219 . . . . 1.0 111.59 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.63 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.3 p -49.79 89.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.151 0 CA-C-O 120.936 0.398 . . . . 1.0 111.182 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.442 ' N ' ' O ' ' A' ' 10' ' ' CYS . 3.6 t-20 173.61 84.49 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 1.0 109.997 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 46.11 27.71 0.56 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.61 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 42.71 32.79 0.41 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.948 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.09 37.58 0.04 OUTLIER Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.131 -1.033 . . . . 1.0 113.195 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -107.41 14.75 25.62 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.679 0.276 . . . . 1.0 110.611 179.47 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' HD13 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -57.1 177.23 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.655 179.79 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.464 ' HB3' HD11 ' A' ' 21' ' ' LEU . 50.3 t -70.17 -108.24 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.029 -0.268 . . . . 1.0 111.524 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.519 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.66 -152.25 0.01 OUTLIER 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.614 0.245 . . . . 1.0 110.745 179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.96 37.38 2.52 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.707 -0.759 . . . . 1.0 112.788 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.1 OUTLIER -69.86 145.03 52.34 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.009 0.433 . . . . 1.0 110.726 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.887 ' HG2' HG23 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -91.7 159.44 15.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.702 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -111.58 114.46 27.53 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.864 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.5 m0 -99.28 101.17 12.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 1.0 110.87 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.02 140.27 36.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 1.0 110.762 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.0 mtt85 -105.27 117.33 33.72 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.111 -0.495 . . . . 1.0 110.484 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 ttt85 -45.93 -31.5 2.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.108 -0.496 . . . . 1.0 111.221 -179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mmt-85 -85.88 -86.62 0.14 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.192 -0.458 . . . . 1.0 110.631 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.0 t -70.39 -164.16 0.08 Allowed 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 120.833 0.349 . . . . 1.0 110.856 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -154.26 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.484 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 10' ' ' CYS . 23.5 mt-10 -109.59 175.64 5.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.666 -0.243 . . . . 1.0 110.368 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.2 t -152.79 139.38 12.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.875 0.369 . . . . 1.0 111.706 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 151.46 21.48 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.958 -0.565 . . . . 1.0 110.409 179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.887 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 m -145.25 122.52 6.25 Favored Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 111.642 0.238 . . . . 1.0 111.642 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 21' ' ' LEU . 38.6 Cg_endo -61.96 142.09 91.7 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 123.24 2.627 . . . . 1.0 112.54 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -81.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.221 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.4 t -69.78 150.11 96.6 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.602 -0.272 . . . . 1.0 111.254 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -73.47 -154.04 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.745 2.297 . . . . 1.0 112.166 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -52.76 106.16 0.15 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 1.0 110.978 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.176 -0.916 . . . . 1.0 111.039 -179.976 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.816 0.341 . . . . 1.0 111.352 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -59.11 87.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.095 -0.502 . . . . 1.0 110.967 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -60.93 155.54 19.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.159 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.51 HD12 ' H ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -69.71 172.07 6.11 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.446 ' CD ' ' HB ' ' A' ' 4' ' ' ILE . 13.3 Cg_exo -68.77 116.16 4.3 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.672 2.248 . . . . 1.0 111.851 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -88.99 39.81 0.95 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.268 -179.68 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 43.1 m95 -150.22 22.35 0.84 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 1.0 110.666 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 13.7 mmtm -115.6 158.5 22.59 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.028 0.442 . . . . 1.0 111.07 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -54.0 173.67 0.59 Allowed Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 115.792 -0.64 . . . . 1.0 113.092 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.8 t -106.55 -2.76 21.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.585 0.231 . . . . 1.0 111.514 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.562 HG13 ' O ' ' A' ' 11' ' ' VAL . 12.7 p -76.88 60.8 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-O 120.944 0.402 . . . . 1.0 111.254 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -178.64 -56.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 1.0 110.728 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.07 -48.19 18.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 52.17 32.05 10.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.938 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 111.56 4.78 26.52 Favored Glycine 0 C--O 1.228 -0.226 0 C-N-CA 120.902 -0.666 . . . . 1.0 112.539 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.86 -0.83 50.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.828 0.314 . . . . 1.0 111.312 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.986 ' HB3' HD13 ' A' ' 21' ' ' LEU . 64.0 m -53.35 170.57 0.09 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.682 -0.235 . . . . 1.0 110.761 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.917 ' SG ' HD11 ' A' ' 21' ' ' LEU . 21.8 p -63.43 -123.94 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 121.231 -0.188 . . . . 1.0 111.451 -179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.514 ' O ' ' N ' ' A' ' 21' ' ' LEU . 1.1 mt-10 -46.77 91.81 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 112.866 0.691 . . . . 1.0 112.866 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.411 ' C ' ' O ' ' A' ' 19' ' ' GLU . . . 18.15 45.61 0.01 OUTLIER Glycine 0 C--N 1.337 0.608 0 CA-C-N 114.962 -1.017 . . . . 1.0 115.452 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.986 HD13 ' HB3' ' A' ' 17' ' ' CYS . 3.0 mp -68.83 161.05 29.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 117.207 0.503 . . . . 1.0 110.894 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -132.89 133.74 43.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.428 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 8.1 p -84.51 115.56 22.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.08 0.467 . . . . 1.0 111.127 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.456 ' CD2' HG21 ' A' ' 34' ' ' VAL . 52.0 m0 -90.19 134.21 34.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.591 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 142.86 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.955 0.407 . . . . 1.0 110.956 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 tpm_? -115.66 135.43 54.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.227 0.537 . . . . 1.0 110.464 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.98 -50.43 19.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.672 -0.694 . . . . 1.0 111.433 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -89.04 -71.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.858 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.19 173.99 6.04 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.293 -0.412 . . . . 1.0 110.751 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -69.99 -146.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.34 -0.391 . . . . 1.0 110.516 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -107.63 131.47 54.35 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 110.447 -0.205 . . . . 1.0 110.447 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 23.4 m -115.41 138.57 45.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.632 0.254 . . . . 1.0 111.625 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -66.01 147.12 53.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.545 179.609 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.456 HG21 ' CD2' ' A' ' 24' ' ' TRP . 2.4 m -149.92 125.13 4.84 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 1.0 111.175 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.704 ' N ' HD23 ' A' ' 21' ' ' LEU . 17.8 Cg_endo -56.61 132.79 53.9 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.768 2.312 . . . . 1.0 112.943 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt -70.26 -111.31 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.761 179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 37' ' ' THR . 10.0 t -70.38 116.33 43.95 Favored Pre-proline 0 CA--C 1.531 0.232 0 O-C-N 122.297 -0.252 . . . . 1.0 111.028 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -71.62 175.81 9.02 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.726 2.284 . . . . 1.0 112.187 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.3 -73.41 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.008 0.432 . . . . 1.0 110.807 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 15.8 m . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.374 -0.822 . . . . 1.0 111.032 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.79 0.329 . . . . 1.0 111.214 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -60.43 129.06 39.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.848 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.59 155.46 9.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.198 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 17' ' ' CYS . 2.4 pp -63.73 140.38 97.8 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.635 -0.257 . . . . 1.0 111.186 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.0 148.15 93.65 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.528 2.152 . . . . 1.0 112.303 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -95.19 38.51 1.13 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.243 -0.435 . . . . 1.0 110.885 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -156.86 27.99 0.32 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.19 -0.459 . . . . 1.0 110.701 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.697 ' C ' HG12 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -120.14 166.54 13.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.033 179.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -66.57 138.49 35.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.897 -0.668 . . . . 1.0 112.725 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.8 p -120.96 26.73 8.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.709 0.29 . . . . 1.0 110.979 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.711 HG21 ' CE2' ' A' ' 30' ' ' PHE . 22.0 t -100.6 71.88 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.142 0.496 . . . . 1.0 111.091 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -176.83 -62.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.937 -0.574 . . . . 1.0 110.613 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.68 -46.3 22.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 55.7 87.2 0.05 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.05 -12.8 9.77 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.386 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.31 -11.67 61.07 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-O 120.642 0.258 . . . . 1.0 111.185 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.456 ' HB3' ' CD1' ' A' ' 21' ' ' LEU . 64.3 m -48.44 144.83 3.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.708 -0.224 . . . . 1.0 110.55 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.3 t -59.61 -102.6 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 121.218 -0.193 . . . . 1.0 111.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -63.3 -157.59 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 N-CA-C 110.291 -0.263 . . . . 1.0 110.291 179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.17 43.12 2.44 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.508 -0.854 . . . . 1.0 112.47 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.456 ' CD1' ' HB3' ' A' ' 17' ' ' CYS . 0.3 OUTLIER -69.71 148.72 48.87 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 120.972 0.415 . . . . 1.0 111.216 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -111.76 151.05 29.42 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.941 -0.572 . . . . 1.0 111.29 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 6.2 m -78.17 120.21 22.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.673 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.419 ' CD2' HG11 ' A' ' 34' ' ' VAL . 6.9 m0 -119.02 139.37 51.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.863 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -81.67 147.39 29.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.963 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -120.02 138.81 53.28 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.104 0.478 . . . . 1.0 110.543 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.12 -57.93 7.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.889 -0.596 . . . . 1.0 111.113 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 -71.91 0.42 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 1.0 110.724 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.99 170.3 8.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.845 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.711 ' CE2' HG21 ' A' ' 11' ' ' VAL . 0.7 OUTLIER -70.24 -145.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.112 -0.495 . . . . 1.0 110.935 179.958 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -97.21 126.63 42.54 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.781 0.324 . . . . 1.0 110.769 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.697 HG12 ' C ' ' A' ' 8' ' ' LYS . 27.6 m -124.15 152.21 29.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 CA-C-N 116.343 -0.389 . . . . 1.0 111.563 -179.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.19 149.05 37.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.215 -0.448 . . . . 1.0 111.173 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.451 HG23 ' HD2' ' A' ' 35' ' ' PRO . 10.8 p -148.58 137.34 11.86 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.527 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.451 ' HD2' HG23 ' A' ' 34' ' ' VAL . 20.9 Cg_endo -56.58 138.27 84.04 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.954 2.436 . . . . 1.0 112.484 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -102.76 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.135 -0.484 . . . . 1.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 63.1 m -70.05 109.25 4.45 Favored Pre-proline 0 C--O 1.232 0.158 0 CA-C-O 120.494 0.188 . . . . 1.0 111.126 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -74.42 149.69 40.02 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 122.719 2.279 . . . . 1.0 112.167 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.7 171.11 1.68 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.883 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 69.9 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.233 -0.889 . . . . 1.0 110.917 -179.991 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.771 0.319 . . . . 1.0 111.17 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.42 132.7 48.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.263 -0.426 . . . . 1.0 110.922 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HA ' ' HB3' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -60.67 141.6 56.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.745 -179.944 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.471 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.1 pt -60.0 157.48 30.87 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.503 -0.317 . . . . 1.0 110.648 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.441 ' HB2' ' CE ' ' A' ' 8' ' ' LYS . 52.5 Cg_exo -53.46 96.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 122.385 2.057 . . . . 1.0 112.002 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.76 151.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.29 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.428 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 38.6 m0 63.4 49.88 3.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.231 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 32' ' ' VAL . 1.5 tptp -117.04 152.76 33.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 1.0 110.809 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -59.43 158.23 23.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.681 -0.771 . . . . 1.0 112.22 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.19 -3.49 45.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.528 0.204 . . . . 1.0 111.325 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.592 ' O ' HG13 ' A' ' 11' ' ' VAL . 8.3 p -69.02 69.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-O 120.908 0.385 . . . . 1.0 110.843 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.424 ' O ' ' HB2' ' A' ' 13' ' ' ARG . 58.6 t-20 -177.97 80.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.054 -0.521 . . . . 1.0 110.506 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 0.8 OUTLIER 68.22 12.12 8.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.572 . . . . 1.0 111.351 -179.784 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 42.34 79.43 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.859 0.361 . . . . 1.0 111.511 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.81 46.01 0.62 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.784 -0.722 . . . . 1.0 112.396 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -96.45 23.79 6.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.906 0.384 . . . . 1.0 111.035 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.724 ' HB3' HD13 ' A' ' 21' ' ' LEU . 2.2 m -70.11 144.56 52.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 1.0 110.403 179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.734 ' SG ' HD11 ' A' ' 21' ' ' LEU . 1.6 p -55.71 -105.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.568 -0.287 . . . . 1.0 111.748 -179.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' HD11 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -57.28 -155.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.644 0.259 . . . . 1.0 110.812 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.411 ' H ' ' HB2' ' A' ' 19' ' ' GLU . . . -71.49 32.02 0.58 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.766 -0.731 . . . . 1.0 114.429 -178.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.734 HD11 ' SG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -73.13 140.06 46.83 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 117.744 0.772 . . . . 1.0 110.186 179.143 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -108.66 162.89 13.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.906 0.384 . . . . 1.0 111.158 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.85 100.38 13.25 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.065 -0.516 . . . . 1.0 110.729 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 25.7 m0 -100.35 144.64 29.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 1.0 111.073 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.56 133.26 39.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.721 -179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -109.97 -172.25 2.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.012 0.434 . . . . 1.0 110.759 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -70.27 -71.52 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.811 -0.632 . . . . 1.0 111.308 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 tpp85 -70.88 -76.42 0.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.038 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.7 p -58.85 147.49 33.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 1.0 110.835 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -57.07 -79.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.373 -0.376 . . . . 1.0 110.497 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -128.64 137.72 51.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.357 -0.383 . . . . 1.0 110.775 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 8' ' ' LYS . 11.2 p -132.8 145.27 34.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.373 -0.376 . . . . 1.0 111.268 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 53.4 m -61.8 137.27 58.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.103 -0.499 . . . . 1.0 110.961 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.0 p -145.52 126.93 7.62 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 116.801 -0.182 . . . . 1.0 111.348 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -59.53 141.85 97.96 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.92 2.413 . . . . 1.0 112.486 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -49.79 -62.68 1.43 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.03 -0.532 . . . . 1.0 111.041 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.454 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 75.5 m -69.8 138.23 87.97 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.686 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 47.8 Cg_endo -93.77 66.07 0.42 Allowed 'Trans proline' 0 N--CA 1.451 -1.0 0 C-N-CA 122.644 2.23 . . . . 1.0 112.331 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 ptmm? -66.59 75.79 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.198 -0.455 . . . . 1.0 110.848 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 60.7 m . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.219 -0.896 . . . . 1.0 110.921 179.999 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.768 0.318 . . . . 1.0 111.133 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.76 93.93 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.15 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -70.42 -169.84 0.34 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.748 -179.887 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 17' ' ' CYS . 1.6 pp -51.9 141.29 28.27 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 1.0 111.66 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -80.08 158.79 23.74 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.787 2.325 . . . . 1.0 111.862 179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HD2' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER -62.04 161.5 10.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.952 179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.443 ' CD1' ' HD2' ' A' ' 6' ' ' LYS . 42.6 m0 62.78 48.06 4.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.222 -0.444 . . . . 1.0 110.921 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -130.03 142.32 50.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.31 175.81 2.25 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.859 -0.686 . . . . 1.0 112.641 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.412 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 1.9 t -104.95 1.88 29.21 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.576 0.214 . . . . 1.0 111.576 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.597 ' O ' HG13 ' A' ' 11' ' ' VAL . 9.0 p -67.39 68.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 CA-C-O 121.124 0.488 . . . . 1.0 111.11 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -169.95 76.74 0.09 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.591 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 75.61 7.17 3.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.245 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 49.04 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.765 0.317 . . . . 1.0 111.35 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 114.4 38.8 1.07 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.962 -0.637 . . . . 1.0 112.495 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.91 20.42 13.24 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.649 0.262 . . . . 1.0 111.252 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.477 ' HA ' HD11 ' A' ' 4' ' ' ILE . 58.4 m -55.39 147.3 17.54 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.561 0.219 . . . . 1.0 110.562 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 3' ' ' CYS . 42.4 t -61.84 -96.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.617 -0.265 . . . . 1.0 110.939 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.504 ' H ' HD11 ' A' ' 21' ' ' LEU . 0.2 OUTLIER -62.56 -154.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 110.028 -0.36 . . . . 1.0 110.028 179.392 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -77.47 33.43 1.59 Allowed Glycine 0 N--CA 1.443 -0.854 0 C-N-CA 120.594 -0.812 . . . . 1.0 112.896 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.504 HD11 ' H ' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -78.62 157.08 28.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.909 0.385 . . . . 1.0 111.042 -179.745 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.461 ' O ' HG22 ' A' ' 34' ' ' VAL . 1.9 pt-20 -132.2 126.24 33.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.347 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 13.2 p -69.48 109.69 4.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.084 0.469 . . . . 1.0 111.115 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.4 ' CE3' HG21 ' A' ' 34' ' ' VAL . 51.2 m0 -97.4 143.74 27.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.861 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -67.5 146.89 53.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.894 0.378 . . . . 1.0 110.895 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 49.2 mmm-85 -128.01 -177.75 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 1.0 110.575 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -78.51 0.07 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.898 -0.592 . . . . 1.0 111.229 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.4 ttm180 -62.39 -73.39 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.331 -0.395 . . . . 1.0 111.12 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.7 m -65.59 168.21 7.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.45 -0.341 . . . . 1.0 110.95 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -81.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.42 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.412 ' HG3' ' HB2' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -153.39 136.38 15.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.31 -0.404 . . . . 1.0 110.64 179.907 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 4.2 m -121.13 141.63 40.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.36 -0.382 . . . . 1.0 111.487 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 23' ' ' CYS . 79.6 m -58.79 133.35 55.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.02 -0.537 . . . . 1.0 111.323 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 22' ' ' GLU . 5.2 m -137.66 133.32 17.83 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.028 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.2 136.94 75.55 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.971 2.448 . . . . 1.0 112.403 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -51.21 -47.05 62.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 83.8 m -69.57 109.74 5.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.87 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.42 -161.28 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.626 2.217 . . . . 1.0 112.187 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.56 129.99 43.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.976 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 83.2 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.243 -0.885 . . . . 1.0 110.731 -179.897 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.776 0.322 . . . . 1.0 111.279 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -59.26 105.43 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.151 -0.477 . . . . 1.0 111.217 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.19 153.08 41.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.463 . . . . 1.0 111.18 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.443 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 2.3 pp -70.3 143.34 90.69 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.4 -0.364 . . . . 1.0 111.258 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 4' ' ' ILE . 3.0 Cg_exo -73.65 140.36 29.4 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.553 2.169 . . . . 1.0 111.661 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HG3' ' CD1' ' A' ' 7' ' ' TRP . 1.0 OUTLIER -55.52 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.984 0.421 . . . . 1.0 111.103 -179.848 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.482 ' CD1' ' HG3' ' A' ' 6' ' ' LYS . 48.0 p-90 41.14 32.34 0.18 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.748 -0.66 . . . . 1.0 111.344 -179.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.83 143.93 31.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.222 -0.445 . . . . 1.0 111.066 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.58 152.49 51.53 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.759 -0.734 . . . . 1.0 112.574 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.9 m -86.13 -4.74 59.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.641 0.258 . . . . 1.0 111.417 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.415 HG21 ' HE1' ' A' ' 30' ' ' PHE . 21.5 t -68.51 72.5 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 120.957 0.408 . . . . 1.0 110.953 179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -176.23 78.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.974 -0.557 . . . . 1.0 110.826 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.46 ' HA ' ' HD2' ' A' ' 13' ' ' ARG . 0.9 OUTLIER 74.63 4.33 4.37 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.071 -0.513 . . . . 1.0 111.642 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 47.13 83.93 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.761 0.315 . . . . 1.0 111.247 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.49 38.21 0.6 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.652 -0.785 . . . . 1.0 112.662 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.443 ' O ' HG21 ' A' ' 4' ' ' ILE . 0.3 OUTLIER -98.97 10.11 42.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.507 0.194 . . . . 1.0 111.295 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.489 ' HB3' HD13 ' A' ' 21' ' ' LEU . 10.0 m -65.9 152.24 44.93 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.656 -0.247 . . . . 1.0 110.534 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.441 ' HB3' HD11 ' A' ' 21' ' ' LEU . 35.4 t -59.22 -100.64 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.769 -0.196 . . . . 1.0 111.048 -179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -70.13 -161.65 0.05 OUTLIER 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.467 0.175 . . . . 1.0 110.558 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -75.45 47.88 2.12 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.609 -0.805 . . . . 1.0 112.192 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.765 HD23 ' HA ' ' A' ' 35' ' ' PRO . 0.3 OUTLIER -70.08 151.1 45.88 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 120.968 0.413 . . . . 1.0 111.069 -179.675 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.94 142.9 26.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.988 -0.551 . . . . 1.0 111.222 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 23.0 t -89.24 103.32 15.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.986 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -81.22 90.09 6.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.165 -0.47 . . . . 1.0 110.75 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.96 133.97 33.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.264 0.554 . . . . 1.0 110.92 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -99.12 117.9 34.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.947 -0.57 . . . . 1.0 110.649 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 -43.27 -31.91 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.369 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -59.14 1.99 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.353 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.06 -179.81 2.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.012 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.415 ' HE1' HG21 ' A' ' 11' ' ' VAL . 0.4 OUTLIER -70.08 -166.74 0.13 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.009 179.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -113.14 160.25 18.42 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.589 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -160.05 131.42 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.582 -0.281 . . . . 1.0 111.207 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.48 149.33 28.79 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.397 -0.365 . . . . 1.0 111.127 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 35' ' ' PRO . 12.7 p -145.35 136.48 12.52 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 1.0 111.287 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.765 ' HA ' HD23 ' A' ' 21' ' ' LEU . 29.8 Cg_endo -58.87 138.63 86.78 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 123.201 2.601 . . . . 1.0 112.625 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -69.72 -40.01 76.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.159 -0.473 . . . . 1.0 111.076 -179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.45 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.4 m -64.84 130.88 95.0 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.933 -0.576 . . . . 1.0 111.145 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 58.2 Cg_endo -93.39 99.22 0.15 Allowed 'Trans proline' 0 N--CA 1.445 -1.324 0 C-N-CA 123.095 2.53 . . . . 1.0 112.373 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.0 mttt -59.59 -74.85 0.06 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.936 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.6 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.116 -0.945 . . . . 1.0 111.01 179.872 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.946 0.403 . . . . 1.0 111.337 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.15 93.36 0.2 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.99 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 18' ' ' CYS . 4.1 m -70.29 -84.87 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.419 -0.355 . . . . 1.0 111.018 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.463 HD11 ' SG ' ' A' ' 17' ' ' CYS . 2.2 pp -70.52 158.13 88.47 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.273 . . . . 1.0 111.263 179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -59.63 98.37 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.434 2.09 . . . . 1.0 111.646 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -46.33 134.49 8.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.003 0.43 . . . . 1.0 111.576 -179.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 28.3 m0 64.29 75.68 0.37 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.173 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 0.0 OUTLIER -156.5 174.55 15.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 1.0 110.61 179.55 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . -55.31 132.13 49.04 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.847 -0.692 . . . . 1.0 112.791 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -98.61 23.64 8.4 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.623 0.249 . . . . 1.0 111.217 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' CD2' ' A' ' 30' ' ' PHE . 20.1 t -75.62 77.75 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.939 0.4 . . . . 1.0 110.972 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -176.9 78.6 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.922 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.1 mmt-85 73.6 5.32 4.9 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.211 -0.449 . . . . 1.0 111.691 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 46.98 34.52 2.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.629 0.252 . . . . 1.0 111.383 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 179.46 35.79 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.411 -0.9 . . . . 1.0 112.816 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.28 14.68 31.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.736 0.303 . . . . 1.0 110.938 179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.463 ' SG ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -70.08 167.62 17.28 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.464 -0.335 . . . . 1.0 111.036 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.535 ' HB2' ' HB2' ' A' ' 3' ' ' CYS . 42.0 t -67.47 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.236 -0.438 . . . . 1.0 111.45 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.33 -155.12 0.0 OUTLIER 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.56 0.219 . . . . 1.0 110.639 -179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -79.25 34.6 1.97 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.618 -0.801 . . . . 1.0 113.282 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.751 HD23 ' CA ' ' A' ' 35' ' ' PRO . 0.4 OUTLIER -69.67 150.24 47.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.9 0.35 . . . . 1.0 110.671 179.701 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.445 ' O ' HG12 ' A' ' 34' ' ' VAL . 4.0 pt-20 -126.3 144.27 50.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.066 0.46 . . . . 1.0 111.112 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.4 m -73.88 124.47 26.19 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.839 -0.619 . . . . 1.0 110.782 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.562 ' CD2' HG11 ' A' ' 34' ' ' VAL . 22.3 m0 -113.73 122.98 48.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.372 -0.376 . . . . 1.0 110.899 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -57.47 150.94 17.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.001 0.429 . . . . 1.0 110.92 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -133.07 141.53 48.26 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.998 -0.547 . . . . 1.0 110.592 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -41.5 66.64 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 1.0 111.134 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -81.49 -81.97 0.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.785 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.83 -179.84 1.97 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.758 -179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.465 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -69.96 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.52 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 mp0 -140.82 140.25 34.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.93 0.395 . . . . 1.0 110.753 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 t -122.98 129.12 75.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 1.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.04 149.49 40.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.282 -0.417 . . . . 1.0 111.221 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.562 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.5 p -147.45 123.59 5.46 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.441 -0.345 . . . . 1.0 111.364 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.751 ' CA ' HD23 ' A' ' 21' ' ' LEU . 29.0 Cg_endo -59.23 138.59 85.74 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.61 2.207 . . . . 1.0 112.651 -179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.15 -30.2 70.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.892 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.474 HG22 ' HD2' ' A' ' 38' ' ' PRO . 8.2 m -68.07 148.77 98.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.26 -0.427 . . . . 1.0 110.97 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.474 ' HD2' HG22 ' A' ' 37' ' ' THR . 2.9 Cg_endo -85.51 124.62 2.76 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 122.908 2.406 . . . . 1.0 112.236 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.78 121.38 14.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.465 . . . . 1.0 110.817 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.229 -0.891 . . . . 1.0 110.852 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.912 0.387 . . . . 1.0 111.17 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -60.25 105.42 0.41 Allowed 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.175 -0.466 . . . . 1.0 111.175 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -70.13 178.37 2.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.861 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.544 HD12 ' C ' ' A' ' 4' ' ' ILE . 2.5 pp -70.18 158.6 87.08 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.848 0.356 . . . . 1.0 110.946 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -61.12 93.76 0.11 Allowed 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.476 2.117 . . . . 1.0 112.23 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.1 mtpp -61.72 146.68 48.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.272 -0.422 . . . . 1.0 110.787 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 35.3 m95 61.69 38.48 15.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.18 -0.464 . . . . 1.0 111.075 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.765 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.8 mmtm -131.07 -176.14 3.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.879 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.49 -170.6 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.688 . . . . 1.0 112.655 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.41 ' O ' ' ND1' ' A' ' 14' ' ' HIS . 1.6 m -115.06 -4.74 12.49 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 111.606 0.224 . . . . 1.0 111.606 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.475 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 18.9 t -68.2 63.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.848 0.356 . . . . 1.0 111.389 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 11' ' ' VAL . 56.9 t-20 174.34 83.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.329 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.1 mmm180 70.38 76.28 0.2 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.307 0.575 . . . . 1.0 110.427 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.41 ' ND1' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -72.14 51.11 0.23 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.302 -0.863 . . . . 1.0 111.338 -179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 163.6 -27.07 0.22 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.536 -0.84 . . . . 1.0 112.62 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.89 26.81 3.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.759 0.314 . . . . 1.0 110.997 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.785 ' HB3' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -49.91 176.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.295 -0.411 . . . . 1.0 111.053 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.572 ' HB3' HD11 ' A' ' 21' ' ' LEU . 41.5 t -55.37 -101.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.326 -0.397 . . . . 1.0 111.671 -179.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.499 ' CG ' ' O ' ' A' ' 19' ' ' GLU . 0.6 OUTLIER -70.78 75.5 0.61 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.924 0.392 . . . . 1.0 110.707 -179.732 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 33.05 33.95 0.02 OUTLIER Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.92 -0.582 . . . . 1.0 113.546 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.785 HD12 ' HB3' ' A' ' 17' ' ' CYS . 0.2 OUTLIER -69.33 150.73 47.03 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 120.911 0.386 . . . . 1.0 111.181 -179.498 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -101.85 164.22 11.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.655 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -101.17 115.53 30.7 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.27 -0.423 . . . . 1.0 110.704 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.483 ' CD2' HG11 ' A' ' 34' ' ' VAL . 23.4 m0 -99.99 100.82 11.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 1.0 110.7 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.71 141.55 28.52 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.845 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.15 125.17 50.74 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.06 -0.518 . . . . 1.0 110.435 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -44.44 -30.18 0.82 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.414 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.3 -67.43 0.92 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.761 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p -69.24 179.31 2.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 1.0 111.118 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -162.23 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.181 -0.463 . . . . 1.0 111.249 -179.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -121.43 139.12 53.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.276 -0.42 . . . . 1.0 110.54 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.765 HG12 ' O ' ' A' ' 8' ' ' LYS . 2.4 m -133.03 163.69 37.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.279 -0.419 . . . . 1.0 111.167 -179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.45 150.5 21.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 1.0 110.933 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.483 HG11 ' CD2' ' A' ' 24' ' ' TRP . 11.6 p -150.84 137.28 11.22 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.998 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.748 ' HA ' HD23 ' A' ' 21' ' ' LEU . 28.9 Cg_endo -58.67 140.28 94.27 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.993 2.462 . . . . 1.0 112.564 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -43.14 75.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.995 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 9.1 t -66.39 153.65 92.34 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.02 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -92.15 123.4 0.66 Allowed 'Trans proline' 0 N--CA 1.449 -1.1 0 C-N-CA 123.27 2.647 . . . . 1.0 112.233 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.7 86.45 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.999 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 76.2 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.127 -0.94 . . . . 1.0 110.929 179.92 . . . . . . . . 0 0 . 1 stop_ save_